Octadecylamine
PubChem CID: 15793
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| Compound Synonyms | OCTADECYLAMINE, octadecan-1-amine, 124-30-1, 1-Octadecanamine, Octadecanamine, Stearylamine, Stearamine, 1-Octadecylamine, n-Octadecylamine, 1-Aminooctadecane, Stearyl amine, Armofilm, n-Stearylamine, Nissan amine AB, Oktadecylamin, Alamine 7, Alamine 7D, Noram SH, Adogenen 142, Armeen 18D, Monooctadecylamine, Armeen 118D, Amine AB, Armeen 18, Farmin 80, Crodamine 1.18D, Kemamine P990, Kemamine P 990, Oktadecylamin [Czech], Armid HTD, NSC 9857, Armeen 1180, CCRIS 4688, HSDB 1194, UNII-FFV58UNY7O, OCTADECANE,1-AMINO, Octadecylamineadogenen 142, EINECS 204-695-3, BRN 0636111, CHEBI:63866, AI3-14661, NSC-9857, Amine 18-90, FFV58UNY7O, OCTADECYLAMINE [HSDB], CHEMBL55860, DTXSID1025801, EC 204-695-3, 4-04-00-00825 (Beilstein Handbook Reference), Octadecyl amine, C18H39N, nOctadecylamine, nStearylamine, 1Octadecanamine, 1Octadecylamine, 1Aminooctadecane, Steamfilm FG, 1-octadecyl amine, EINECS 262-976-6, MFCD00008159, Octadecylamine, 97%, octadecane, 1-amino-, 1-Octadecanamine, 9CI, STEARAMINE [INCI], EC 262-976-6, GENAMIN SH 100, NCIOpen2_007744, SCHEMBL12291, DTXCID505801, SCHEMBL2159903, SCHEMBL3868686, SCHEMBL6253291, WLN: Z18, Kemamine P-990, P-990D, NSC9857, Octadecylamine, >=99.0% (GC), STR09001, BDBM50147579, STK062786, AKOS000269090, Octadecylamine, technical grade, 90%, CS-W012394, FO74933, NCGC00164134-01, NS00009570, O0014, EN300-18141, D70506, A833419, Q2013790, Z57204689, F3145-0795 |
|---|---|
| Ghose Rule | False |
| Classyfire Kingdom | Organic compounds |
| Topological Polar Surface Area | 26.0 |
| Hydrogen Bond Donor Count | 1.0 |
| Pfizer 3 75 Rule | False |
| Np Classifier Class | Hydrocarbons |
| Deep Smiles | CCCCCCCCCCCCCCCCCCN |
| Heavy Atom Count | 19.0 |
| Classyfire Class | Organonitrogen compounds |
| Classyfire Subclass | Amines |
| Isotope Atom Count | 0.0 |
| Molecular Complexity | 145.0 |
| Database Name | hmdb_chem_all;imppat_phytochem;pubchem |
| Defined Atom Stereocenter Count | 0.0 |
| Iupac Name | octadecan-1-amine |
| Class | Organonitrogen compounds |
| Veber Rule | False |
| Classyfire Superclass | Organic nitrogen compounds |
| Xlogp | 8.5 |
| Superclass | Organic nitrogen compounds |
| Subclass | Amines |
| Gsk 4 400 Rule | False |
| Molecular Formula | C18H39N |
| Inchi Key | REYJJPSVUYRZGE-UHFFFAOYSA-N |
| Silicos It Class | Poorly soluble |
| Rotatable Bond Count | 16.0 |
| State | Solid |
| Synonyms | 1-Aminooctadecane, 1-Octadecanamine, 1-Octadecylamine, Monooctadecylamine, N-Octadecylamine, N-Stearylamine, Stearamine, Stearyl amine, Stearylamine, 1-Octadecanamine, 9ci, Adogenen 142, Alamine 7, Alamine 7D, Amine ab, Amines, hydrogenated tallow alkyl, Armeen 1180, Armeen 118D, Armeen 18, Armeen 18D, Armid HTD, Armofilm, Crodamine 1.18D, Farmin 80, Hydrogenated tallowamine, Kemamine p 990, Kemamine p-990, p-990D, Kemamine P990, Nissan amine ab, Noram SH, Octadecan-1-amine, OCTADECANE,1-amino, Octadecylamineadogenen 142, Oktadecylamin, Steamfilm FG, Tallow amine, hydrogenated, 1-Octadecanamine, hydrochloride, Octadecyl ammonium chloride, Stearylamine hydrochloride, Octadecylamine hydrochloride, 1-Octadecanamine, hydrochloride (1:1), Stearylammonium chloride, Octadecylamine, 1-octadecanamine |
| Esol Class | Soluble |
| Functional Groups | CN |
| Compound Name | Octadecylamine |
| Kingdom | Organic compounds |
| Exact Mass | 269.308 |
| Formal Charge | 0.0 |
| Monoisotopic Mass | 269.308 |
| Hydrogen Bond Acceptor Count | 1.0 |
| Molecular Weight | 269.5 |
| 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 |
| Inchi | InChI=1S/C18H39N/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19/h2-19H2,1H3 |
| Smiles | CCCCCCCCCCCCCCCCCCN |
| Np Classifier Biosynthetic Pathway | Fatty acids |
| Defined Bond Stereocenter Count | 0.0 |
| Egan Rule | False |
| Taxonomy Direct Parent | Monoalkylamines |
| Np Classifier Superclass | Fatty acyls |
- 1. Outgoing r'ship
FOUND_INto/from Pistacia Chinensis (Plant) Rel Props:Reference:https://doi.org/10.1080/10412905.1998.9700907