2-Naphthaldehyde
PubChem CID: 6201
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| Compound Synonyms | 2-Naphthaldehyde, 66-99-9, 2-Naphthalenecarboxaldehyde, naphthalene-2-carbaldehyde, beta-Naphthaldehyde, 2-Formylnaphthalene, beta-Formylnaphthalene, beta-Naphthylaldehyde, .beta.-Naphthaldehyde, .beta.-Formylnaphthalene, beta-Naphthylcarboxaldehyde, 2-naphthalenealdehyde, .beta.-Naphthylcarboxaldehyde, .beta.-Naphthylaldehyde, NSC 8557, 2-naphthylaldehyde, naphthalene-2-carboxaldehyde, EINECS 200-640-2, GZX30H50DE, BRN 0507750, CHEBI:52368, 2-naphthylcarboxaldehyde, NSC-8557, MFCD00004094, UNII-GZX30H50DE, DTXSID6075352, 4-07-00-01288 (Beilstein Handbook Reference), 2-Formylnaphthalene, 2-Naphthalenealdehyde, Naphth2aldehyde, 2-naphtaldehyde, b-Naphthaldehyde, 2-Napthaldehyde, naphthyl aldehyde, 2-naphtoaldehyde, 2-naphthal, betaNaphthaldehyde, 2-naphthoaldehyde, 2Formylnaphthalene, 2-naphthalaldehyde, b-Formylnaphthalene, betaNaphthylaldehyde, ss--Naphthaldehyde, beta-naphthoaldehyde, betaFormylnaphthalene, naphthalene-2-aldehyde, 2-naphthalenecarbaldehyde, betaNaphthylcarboxaldehyde, 2Naphthalenecarboxaldehyde, 2-naphthalencarboxaldehyde, Naphtalene-2-carbaldehyde, 2-Naphthaldehyde, 98%, naphthalene-2 carbaldehyde, bmse000679, 2-Naphathalenecarboxaldehyde, SCHEMBL51340, CHEMBL2289234, DTXCID7044687, NSC8557, Formylnaphthalene, 2-Naphthaldehyde, 2-Naphthalenecarboxaldehyde (9CI), BCP26680, CS-D1121, HY-Y0075, AKOS000120509, AC-1415, FN08328, AS-14485, BP-12503, DB-021404, N0003, NS00041031, EN300-20918, F10988, Q27104792, F2191-0027, Z104484858, 200-640-2 |
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| Topological Polar Surface Area | 17.1 |
| Hydrogen Bond Donor Count | 0.0 |
| Heavy Atom Count | 12.0 |
| Isotope Atom Count | 0.0 |
| Molecular Complexity | 164.0 |
| Database Name | cmaup_ingredients;npass_chem_all;pubchem |
| Defined Atom Stereocenter Count | 0.0 |
| Uniprot Id | P0A0J7, P31648 |
| Iupac Name | naphthalene-2-carbaldehyde |
| Prediction Hob | 1.0 |
| Xlogp | 3.0 |
| Molecular Formula | C11H8O |
| Prediction Swissadme | 0.0 |
| Inchi Key | PJKVFARRVXDXAD-UHFFFAOYSA-N |
| Fcsp3 | 0.0 |
| Logs | -3.593 |
| Rotatable Bond Count | 1.0 |
| Logd | 2.756 |
| Compound Name | 2-Naphthaldehyde |
| Prediction Hob Swissadme | 0.0 |
| Exact Mass | 156.058 |
| Formal Charge | 0.0 |
| Monoisotopic Mass | 156.058 |
| Hydrogen Bond Acceptor Count | 1.0 |
| Molecular Weight | 156.18 |
| Covalent Unit Count | 1.0 |
| Total Atom Stereocenter Count | 0.0 |
| Total Bond Stereocenter Count | 0.0 |
| Esol | -2.883607466666667 |
| Inchi | InChI=1S/C11H8O/c12-8-9-5-6-10-3-1-2-4-11(10)7-9/h1-8H |
| Smiles | C1=CC=C2C=C(C=CC2=C1)C=O |
| Nring | 2.0 |
| Defined Bond Stereocenter Count | 0.0 |
- 1. Outgoing r'ship
FOUND_INto/from Diospyros Ebenum (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all