(5Z)-dodeca-5,7-dien-5-ol

C12H22O — CID 87161212

IUPAC(5Z)-dodeca-5,7-dien-5-ol
SMILESCCCCC=C/C=C(\O)CCCC
InChIInChI=1S/C12H22O/c1-3-5-7-8-9-11-12(13)10-6-4-2/h8-9,11,13H,3-7,10H2,1-2H3/b9-8?,12-11-
InChIKeyYGELKALLBUKMNI-ZMLDDQSSSA-N
MW182.31 g/mol
LogP4.36
Rot. Bonds7

About (5Z)-dodeca-5,7-dien-5-ol

(5Z)-dodeca-5,7-dien-5-ol (PubChem CID 87161212) has the molecular formula C12H22O and a molecular weight of 182.31 g/mol. Its IUPAC name is (5Z)-dodeca-5,7-dien-5-ol.

Molecular Properties

Compound Name(5Z)-dodeca-5,7-dien-5-ol
PubChem CID87161212
Molecular FormulaC12H22O
Molecular Weight182.31 g/mol
Exact Mass182.17
IUPAC Name(5Z)-dodeca-5,7-dien-5-ol
SMILESCCCCC=C/C=C(\O)CCCC
InChIInChI=1S/C12H22O/c1-3-5-7-8-9-11-12(13)10-6-4-2/h8-9,11,13H,3-7,10H2,1-2H3/b9-8?,12-11-
InChIKeyYGELKALLBUKMNI-ZMLDDQSSSA-N
XLogP4.36
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.31
LogP ≤ 54.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'polyene', 'substructure': 'N/A'}

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Related Compounds

1,1-difluoroocta-1,3-diene
CID 150749668
1,1-dichloroocta-1,3-diene;palladium
CID 87090262
2-propyldeca-2,4-dienoic acid
CID 54309324
(5E,7Z)-13-methylideneheptadeca-5,7-diene
CID 57162564
(2E,4Z)-2-hexyldeca-2,4-dienoic acid
CID 87447693
potassium 2-hydroxyicosa-2,4-dienoate
CID 172807710
2-pentadecylicosa-2,4-dienoic acid
CID 175591477
(1E)-octa-1,3-dien-1-ol
CID 154003406
(3E,5E)-deca-3,5-dien-1-ol
CID 118460601
4-O-[(2Z,4E)-2-hydroxynona-2,4-dienyl] 1-O-methyl (Z)-but-2-enedioate
CID 139813864
(6E,8E,10E)-pentadeca-6,8,10-trienoic acid
CID 101132736
9-pentyltetradeca-6,8-dienoic acid
CID 123536304

Frequently Asked Questions

What is the IUPAC name of (5Z)-dodeca-5,7-dien-5-ol?
The IUPAC name of (5Z)-dodeca-5,7-dien-5-ol (CID 87161212) is (5Z)-dodeca-5,7-dien-5-ol.
What is the SMILES notation for (5Z)-dodeca-5,7-dien-5-ol?
The canonical SMILES for (5Z)-dodeca-5,7-dien-5-ol is CCCCC=C/C=C(\O)CCCC.
What is the InChIKey of (5Z)-dodeca-5,7-dien-5-ol?
The InChIKey is YGELKALLBUKMNI-ZMLDDQSSSA-N. The full InChI is InChI=1S/C12H22O/c1-3-5-7-8-9-11-12(13)10-6-4-2/h8-9,11,13H,3-7,10H2,1-2H3/b9-8?,12-11-.
What are the key properties of (5Z)-dodeca-5,7-dien-5-ol?
(5Z)-dodeca-5,7-dien-5-ol has a molecular weight of 182.31 g/mol, XLogP of 4.36, 7 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (5Z)-dodeca-5,7-dien-5-ol is sourced from PubChem (CID 87161212), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).