9,12,15-Octadecatrien-1-ol

HCID 68169
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Basic information

CAS
2774-90-5
Standard SMILES
CCC=CCC=CCC=CCCCCCCCCO
InChIKey
IKYKEVDKGZYRMQ-UHFFFAOYSA-N
Molecular formula
C18H32O
Average molar mass
264.4 g/mol
Monoisotopic mass
264.24531564

Names & identifiers

Preferred name
9,12,15-Octadecatrien-1-ol
IUPAC
octadeca-9,12,15-trien-1-ol
English name
9,12,15-Octadecatrien-1-ol
Molecular formula
C18H32O
Molecular weight
264.45

Names & synonyms

DTXSID102757022774-90-5RefChem:107546DTXCID702271069,12,15-Octadecatrien-1-ol9,12,15-Octadecatrienol(9Z,12Z,15Z)-octadecatrien-1-olSCHEMBL290115SCHEMBL1740658IKYKEVDKGZYRMQ-UHFFFAOYSA-Noctadeca-9,12,15-trien-1-olZ9Z12Z15-18OH

Database identifiers

CAS
2774-90-5
PubChem CID
68169
DTXSID
DTXSID10275702

Properties

Computed structural properties

XLogP
6.1
Topological polar surface area
20.2 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
1
Rotatable bonds
13
Heavy atoms
19

Physicochemical properties

Boiling point
374.2 · 374.2±11.0 °C(Predicted)
Density
0.869 · 0.869±0.06 g/cm3(Predicted)
pka
15.2 · 15.20±0.10(Predicted)

Related reactions

3 records
New reaction record

Compound notes

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