1-Tetradecanol
PubChem CID: 8209
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| Compound Synonyms | 1-TETRADECANOL, Tetradecan-1-ol, 112-72-1, Myristyl alcohol, Tetradecanol, Tetradecyl alcohol, n-Tetradecanol, Myristic alcohol, n-Tetradecyl alcohol, Lanette K, Loxanol V, n-Tetradecanol-1, n-Tetradecan-1-ol, 1-Hydroxytetradecane, Alfol 14, kalcohl 40, Dytol R-52, Lanette 14, Alcohol(C14), tetradecan1-ol, Polyethylene monoalcohol, 1-Tetradecyl alcohol, Tetradecanol (7CI), Kalcohl 4098, Adol 18, Lorol C 14, Kalcol 4098, Myristyl alcohol [NF], Conol 1495, HSDB 5168, Tetradecanol-1, Nacol 14-95, NSC 8549, NSC-8549, EINECS 204-000-3, MFCD00004757, EPA Pesticide Chemical Code 001510, Philcohol 1400, Lorol C14, DTXSID9026926, CHEBI:77417, AI3-00943, Epal 14, Myristyl alcohol (NF), MYRISTYL ALCOHOL [II], MYRISTYL ALCOHOL [MI], MYRISTYL ALCOHOL [FCC], DTXCID406926, MYRISTYL ALCOHOL [HSDB], 27196-00-5, MYRISTYL ALCOHOL [MART.], NSC8549, MYRISTYL ALCOHOL [USP-RS], MYRISTYL ALCOHOL [WHO-DD], V42034O9PU, 4-01-00-01864 (Beilstein Handbook Reference), C14 alcohol, MYRISTYL ALCOHOL (II), MYRISTYL ALCOHOL (MART.), MYRISTYL ALCOHOL (USP-RS), Myristyl alcohol, n-Tetradecan-1-ol, CAS-112-72-1, C14-15 alcohol, BRN 1742652, UNII-S4827SZE3L, nTetradecanol, 1tetradecanol, nTetradecanol1, UNII-V42034O9PU, tetradecylalcohol, 1Hydroxytetradecane, nTetradecyl alcohol, EINECS 267-019-6, EINECS 268-107-7, EINECS 272-490-6, EINECS 275-983-4, Dytol R52, Myristyl cetyl alcohol, 1-Tetradecanol, 97%, SDA 15-060-00, EC 204-000-3, EC 616-261-4, SCHEMBL20286, CHEMBL24022, S4827SZE3L, WLN: Q14, MYRISTYL ALCOHOL [INCI], DTXSID0042456, 14 OH, EINECS 267-009-1, EINECS 269-790-4, Tox21_201842, Tox21_300538, LMFA05000041, STL453593, AKOS009031495, CS-W004294, HY-W004294, NCGC00164345-01, NCGC00164345-02, NCGC00164345-03, NCGC00254322-01, NCGC00259391-01, BP-30124, DA-59961, (USEPA/OPP Pesticide Code: 001510), 1-Tetradecanol, purum, >=95.0% (GC), NS00002926, T0084, EN300-19955, 1-Tetradecanol, Selectophore(TM), >=99.0%, D05097, D77653, Q161683, F7FCB87C-0FA4-412A-BC8C-BE5C952BC1E0, Myristyl alcohol, United States Pharmacopeia (USP) Reference Standard, Myristyl Alcohol, Pharmaceutical Secondary Standard, Certified Reference Material, 204-000-3, 248-318-0 |
|---|---|
| Ghose Rule | True |
| Classyfire Kingdom | Organic compounds |
| Topological Polar Surface Area | 20.2 |
| Hydrogen Bond Donor Count | 1.0 |
| Pfizer 3 75 Rule | False |
| Np Classifier Class | Fatty alcohols |
| Deep Smiles | CCCCCCCCCCCCCCO |
| Heavy Atom Count | 15.0 |
| Classyfire Class | Fatty acyls |
| Description | Flavouring ingredient. 1-Tetradecanol is found in kohlrabi. |
| Classyfire Subclass | Fatty alcohols |
| Isotope Atom Count | 0.0 |
| Molecular Complexity | 102.0 |
| Database Name | cmaup_ingredients;fooddb_chem_all;hmdb_chem_all;imppat_phytochem;npass_chem_all;pubchem |
| Defined Atom Stereocenter Count | 0.0 |
| Enzyme Uniprot Id | Q8WVX9, Q96K12, Q58HT5, Q6E213 |
| Uniprot Id | O00116, Q8WVX9, Q96K12, Q58HT5, Q6E213, Q96RI1, n.a., Q03181 |
| Iupac Name | tetradecan-1-ol |
| Prediction Hob | 1.0 |
| Class | Fatty Acyls |
| Veber Rule | False |
| Classyfire Superclass | Lipids and lipid-like molecules |
| Xlogp | 6.2 |
| Superclass | Lipids and lipid-like molecules |
| Subclass | Fatty alcohols |
| Gsk 4 400 Rule | False |
| Molecular Formula | C14H30O |
| Prediction Swissadme | 0.0 |
| Inchi Key | HLZKNKRTKFSKGZ-UHFFFAOYSA-N |
| Silicos It Class | Moderately soluble |
| Fcsp3 | 1.0 |
| Logs | -5.801 |
| Rotatable Bond Count | 12.0 |
| State | Solid |
| Logd | 3.809 |
| Synonyms | 1-Hydroxytetradecane, 1-Tetradecyl alcohol, Adol 18, Alfol 14, Conol 1495, Kalcohl 40, Kalcohl 4098, Kalcol 4098, Lanette 14, Lanette k, Lanette wax ks, Lorol C 14, Loxanol V, Myristic alcohol, Myristryl alcohol, Myristyl alcohol, N-Tetradecan-1-ol, N-Tetradecanol, N-Tetradecanol-1, N-Tetradecyl alcohol, Nacol 14-95, Tetradecan-1-ol, Tetradecanol, Tetradecanol (7ci), Tetradecyl alcohol, 1-Tetradecanol, Lanette K, Lanette wax KS, Myristyl alcohol, aluminum salt, 1-tetradecanol, myristyl alcoho, tetradecan-1-ol, tetradecan-1-ol (alfol14), tetradecanol, tetradecanol (myristyl alcohol), tetradecanol * |
| Substituent Name | Long chain fatty alcohol, Hydrocarbon derivative, Primary alcohol, Organooxygen compound, Alcohol, Aliphatic acyclic compound |
| Esol Class | Moderately soluble |
| Functional Groups | CO |
| Compound Name | 1-Tetradecanol |
| Kingdom | Organic compounds |
| Prediction Hob Swissadme | 0.0 |
| Exact Mass | 214.23 |
| Formal Charge | 0.0 |
| Monoisotopic Mass | 214.23 |
| Hydrogen Bond Acceptor Count | 1.0 |
| Molecular Weight | 214.39 |
| Gi Absorption | True |
| Covalent Unit Count | 1.0 |
| Total Atom Stereocenter Count | 0.0 |
| Total Bond Stereocenter Count | 0.0 |
| Molecular Framework | Aliphatic acyclic compounds |
| Lipinski Rule Of 5 | True |
| Esol | -4.1761365999999995 |
| Inchi | InChI=1S/C14H30O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15/h15H,2-14H2,1H3 |
| Smiles | CCCCCCCCCCCCCCO |
| Nring | 0.0 |
| Np Classifier Biosynthetic Pathway | Fatty acids |
| Defined Bond Stereocenter Count | 0.0 |
| Egan Rule | True |
| Taxonomy Direct Parent | Long-chain fatty alcohols |
| Np Classifier Superclass | Fatty acyls |
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FOUND_INto/from Angelica Acutiloba (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all - 7. Outgoing r'ship
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FOUND_INto/from Angelica Dahurica (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all - 11. Outgoing r'ship
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FOUND_INto/from Angelica Sinensis (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all - 27. Outgoing r'ship
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FOUND_INto/from Anisochilus Carnosus (Plant) Rel Props:Reference:https://doi.org/10.1080/0972-060x.2003.10643332 - 34. Outgoing r'ship
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FOUND_INto/from Aquilaria Agallocha (Plant) Rel Props:Reference:https://doi.org/10.1080/10412905.2005.9699008 - 36. Outgoing r'ship
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FOUND_INto/from Brassica Oleracea (Plant) Rel Props:Source_db:cmaup_ingredients;fooddb_chem_all;npass_chem_all - 45. Outgoing r'ship
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FOUND_INto/from Cordia Sinensis (Plant) Rel Props:Reference: - 57. Outgoing r'ship
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FOUND_INto/from Rosa Damascena (Plant) Rel Props:Reference:https://doi.org/10.1002/(sici)1099-1026(199701)12:1<37::aid-ffj605>3.0.co;2-v - 158. Outgoing r'ship
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FOUND_INto/from Saccharum Sinensis (Plant) Rel Props:Reference: - 160. Outgoing r'ship
FOUND_INto/from Scopolia Sinensis (Plant) Rel Props:Reference: - 161. Outgoing r'ship
FOUND_INto/from Selaginella Sinensis (Plant) Rel Props:Reference: - 162. Outgoing r'ship
FOUND_INto/from Senna Alata (Plant) Rel Props:Reference:https://doi.org/10.1080/10412905.2005.9698946 - 163. Outgoing r'ship
FOUND_INto/from Senna Auriculata (Plant) Rel Props:Reference:ISBN:9770972795006 - 164. Outgoing r'ship
FOUND_INto/from Spartium Junceum (Plant) Rel Props:Reference:https://doi.org/10.1080/10412905.2004.9698800 - 165. Outgoing r'ship
FOUND_INto/from Spilanthes Oleracea (Plant) Rel Props:Reference: - 166. Outgoing r'ship
FOUND_INto/from Spinacia Oleracea (Plant) Rel Props:Reference: - 167. Outgoing r'ship
FOUND_INto/from Spiranthes Sinensis (Plant) Rel Props:Reference: - 168. Outgoing r'ship
FOUND_INto/from Tinospora Sinensis (Plant) Rel Props:Reference: - 169. Outgoing r'ship
FOUND_INto/from Toona Sinensis (Plant) Rel Props:Reference: - 170. Outgoing r'ship
FOUND_INto/from Uncaria Sinensis (Plant) Rel Props:Reference: - 171. Outgoing r'ship
FOUND_INto/from Vanilla Planifolia (Plant) Rel Props:Reference:https://doi.org/10.15482/usda.adc/1239279 - 172. Outgoing r'ship
FOUND_INto/from Vicia Sativa (Plant) Rel Props:Reference:https://doi.org/10.1080/10412905.2009.9700101 - 173. Outgoing r'ship
FOUND_INto/from Wisteria Sinensis (Plant) Rel Props:Reference: - 174. Outgoing r'ship
FOUND_INto/from Zanthoxylum Armatum (Plant) Rel Props:Reference:https://doi.org/10.1002/(sici)1099-1026(199907/08)14:4<225::aid-ffj818>3.0.co;2-1 - 175. Outgoing r'ship
FOUND_INto/from Ziziphora Capitata (Plant) Rel Props:Reference:https://doi.org/10.1080/0972060x.2009.10643774