CCCCCCCCC=CCCCCCCCC(=O)O
CAS: 2027-47-6
Name: octadec-9-enoic acid
SMILES: CCCCCCCCC=CCCCCCCCC(=O)O

Molecular Processing

Molecular formula
C18H34O2
Molecular weight
282.47
Exact mass
282.2559
XLogP
6.11
TPSA
37.3
H-bond donors
1
H-bond acceptors
1
Rotatable bonds
15
Heavy atoms
20
Rings
0
Aromatic rings
0
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
2
Covalent units
1
Fraction Csp3
0.833
Molar refractivity
87.09

Supplementary Information

InChIKey: ZQPPMHVWECSIRJ-UHFFFAOYSA-N
Synonyme
9-octadecenoic acidOctadec-9-enoic acid2027-47-6DTXSID7048118CHEBI:36021RefChem:1075027DTXCID4028090217-977-6odorlessMangroven-Octadec-9-ensaureOleic acid-ul-13C18Oleic acid-9,10-d2NCIMech_000314SCHEMBL1139NCIOpen2_008144Oleic Acid_GurudeebanSatyavaniSCHEMBL6344575287100-82-7MLA10082AKOS030228306NCI60_042203DB-041119DB-253685NS00081299Q27116668
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