(4S)-undeca-1,2-dien-4-ol

C11H20O — CID 12034300

IUPAC(4S)-undeca-1,2-dien-4-ol
SMILESC=C=C[C@@H](O)CCCCCCC
InChIInChI=1S/C11H20O/c1-3-5-6-7-8-10-11(12)9-4-2/h9,11-12H,2-3,5-8,10H2,1H3/t11-/m1/s1
InChIKeyRKAQZCYXAFHXCF-LLVKDONJSA-N
MW168.28 g/mol
LogP3.05
Rot. Bonds7

About (4S)-undeca-1,2-dien-4-ol

(4S)-undeca-1,2-dien-4-ol (PubChem CID 12034300) has the molecular formula C11H20O and a molecular weight of 168.28 g/mol. Its IUPAC name is (4S)-undeca-1,2-dien-4-ol.

Molecular Properties

Compound Name(4S)-undeca-1,2-dien-4-ol
PubChem CID12034300
Molecular FormulaC11H20O
Molecular Weight168.28 g/mol
Exact Mass168.15
IUPAC Name(4S)-undeca-1,2-dien-4-ol
SMILESC=C=C[C@@H](O)CCCCCCC
InChIInChI=1S/C11H20O/c1-3-5-6-7-8-10-11(12)9-4-2/h9,11-12H,2-3,5-8,10H2,1H3/t11-/m1/s1
InChIKeyRKAQZCYXAFHXCF-LLVKDONJSA-N
XLogP3.05
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.28
LogP ≤ 53.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

1-Octen-3-Ol
CID 18827
1-Nonen-3-ol
CID 89560
1-Decen-3-ol
CID 170977
(R)-oct-1-en-3-ol
CID 6992244
1-Undecen-3-ol
CID 3015762
(S)-1-Octen-3-ol
CID 2724898
7-Octen-2-ol
CID 542172
1-Nonen-4-ol
CID 141975
Dodecen-3-ol
CID 107213
2-Undecen-4-ol
CID 5366258
11-Dodecen-2-ol
CID 10702653
Tetradec-1-en-3-ol
CID 11183463

Frequently Asked Questions

What is the IUPAC name of (4S)-undeca-1,2-dien-4-ol?
The IUPAC name of (4S)-undeca-1,2-dien-4-ol (CID 12034300) is (4S)-undeca-1,2-dien-4-ol.
What is the SMILES notation for (4S)-undeca-1,2-dien-4-ol?
The canonical SMILES for (4S)-undeca-1,2-dien-4-ol is C=C=C[C@@H](O)CCCCCCC.
What is the InChIKey of (4S)-undeca-1,2-dien-4-ol?
The InChIKey is RKAQZCYXAFHXCF-LLVKDONJSA-N. The full InChI is InChI=1S/C11H20O/c1-3-5-6-7-8-10-11(12)9-4-2/h9,11-12H,2-3,5-8,10H2,1H3/t11-/m1/s1.
What are the key properties of (4S)-undeca-1,2-dien-4-ol?
(4S)-undeca-1,2-dien-4-ol has a molecular weight of 168.28 g/mol, XLogP of 3.05, 7 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (4S)-undeca-1,2-dien-4-ol is sourced from PubChem (CID 12034300), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).