| 2D Structure | |
| CID | 12398 |
| Target | CYP1A2 , ESR1 |
| IUPAC Name | heptadecane |
| InChI | InChI=1S/C17H36/c1-3-5-7-9-11-13-15-17-16-14-12-10-8-6-4-2/h3-17H2,1-2H3 |
| InChI Key | NDJKXXJCMXVBJW-UHFFFAOYSA-N |
| Canonical SMILES | CCCCCCCCCCCCCCCCC |
| Isomeric SMILES | CCCCCCCCCCCCCCCCC |
| Molecular Formula | C17H36 |
| Molecular Weight | 240.5 |
| synonyms | ['HEPTADECANE', 'n-Heptadecane', 'Heptadekan', 'EINECS 211-108-4', 'Normal-heptadecane', 'NSC 172782', 'BRN 1738898', 'DTXSID7047061', 'CHEBI:16148', 'AI3-36898', 'NSC-172782', 'DTXCID5027061', 'HSDB 8347', 'CH3-[CH2]15-CH3', '4-01-00-00548 (Beilstein Handbook Reference)', 'CH3-(CH2)15-CH3', 'nHeptadecane', 'Heptadecane, n', 'inchi=1/c17h36/c1-3-5-7-9-11-13-15-17-16-14-12-10-8-6-4-2/h3-17h2,1-2h', 'ndjkxxjcmxvbjw-uhfffaoysa-n', '629-78-7', 'MFCD00009002', 'H7C0J39XUM', 'Hexadecane, methyl-', 'Heptadecane, analytical standard', 'Heptadecane; NSC 172782; TS 7; n-Heptadecane', 'UNII-H7C0J39XUM', 'Heptadecane purum', 'PJ8', 'Heptadecane, 99%', 'n-Heptadecane (d36)', 'CHEMBL3185332', 'Tox21_302278', 'LMFA11000003', 'NSC172782', 'STL355860', 'AKOS000487450', 'HY-W131351', 'Heptadecane, purum, >=98.0% (GC)', 'NCGC00256101-01', 'AS-56326', 'CAS-629-78-7', 'DB-054356', 'CS-0197341', 'H0023', 'NS00012511', 'C01816', 'D97702', 'Q150888', '43B472DE-3A6B-4855-8457-9D679B0D1C87'] |
From Pubchem