undec-3-en-2-ol

C11H22O — CID 174515693

IUPACundec-3-en-2-ol
SMILESCCCCCCCC=CC(C)O
InChIInChI=1S/C11H22O/c1-3-4-5-6-7-8-9-10-11(2)12/h9-12H,3-8H2,1-2H3
InChIKeyJGFSMQNCDSUWBM-UHFFFAOYSA-N
MW170.30 g/mol
LogP3.28
Rot. Bonds7

About undec-3-en-2-ol

undec-3-en-2-ol (PubChem CID 174515693) has the molecular formula C11H22O and a molecular weight of 170.30 g/mol. Its IUPAC name is undec-3-en-2-ol.

Molecular Properties

Compound Nameundec-3-en-2-ol
PubChem CID174515693
Molecular FormulaC11H22O
Molecular Weight170.30 g/mol
Exact Mass170.17
IUPAC Nameundec-3-en-2-ol
SMILESCCCCCCCC=CC(C)O
InChIInChI=1S/C11H22O/c1-3-4-5-6-7-8-9-10-11(2)12/h9-12H,3-8H2,1-2H3
InChIKeyJGFSMQNCDSUWBM-UHFFFAOYSA-N
XLogP3.28
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.30
LogP ≤ 53.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

(Z,2R)-non-3-en-2-ol
CID 11040800
(E,2S,3S)-3-methylundec-4-en-2-ol
CID 10465011
(Z,4R)-2-methyldodec-5-en-4-ol
CID 14961442
(E,2S)-dec-3-ene-1,2-diol
CID 101192698
henicos-7-en-6-ol
CID 91409967
(E,2R,3R)-1,2-diaminooctadec-4-ene-1,3-diol
CID 140541829
2-chlorodec-3-ene
CID 71337420
(Z,2S,3R)-non-4-ene-2,3-diol
CID 11321105
dec-3-ene-2,9-diol
CID 57127068
3-methyltetradec-4-ene
CID 123180851
(E)-1-aminodec-3-en-2-ol
CID 101275263
(3S,4Z)-undeca-1,4-dien-3-ol
CID 129408350

Frequently Asked Questions

What is the IUPAC name of undec-3-en-2-ol?
The IUPAC name of undec-3-en-2-ol (CID 174515693) is undec-3-en-2-ol.
What is the SMILES notation for undec-3-en-2-ol?
The canonical SMILES for undec-3-en-2-ol is CCCCCCCC=CC(C)O.
What is the InChIKey of undec-3-en-2-ol?
The InChIKey is JGFSMQNCDSUWBM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22O/c1-3-4-5-6-7-8-9-10-11(2)12/h9-12H,3-8H2,1-2H3.
What are the key properties of undec-3-en-2-ol?
undec-3-en-2-ol has a molecular weight of 170.30 g/mol, XLogP of 3.28, 7 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for undec-3-en-2-ol is sourced from PubChem (CID 174515693), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).