10-hydroxyundec-1-en-6-one

C11H20O2 — CID 10821365

IUPAC10-hydroxyundec-1-en-6-one
SMILESC=CCCCC(=O)CCCC(C)O
InChIInChI=1S/C11H20O2/c1-3-4-5-8-11(13)9-6-7-10(2)12/h3,10,12H,1,4-9H2,2H3
InChIKeyQOQZFWWLTAMSDW-UHFFFAOYSA-N
MW184.28 g/mol
LogP2.46
Rot. Bonds8

About 10-hydroxyundec-1-en-6-one

10-hydroxyundec-1-en-6-one (PubChem CID 10821365) has the molecular formula C11H20O2 and a molecular weight of 184.28 g/mol. Its IUPAC name is 10-hydroxyundec-1-en-6-one.

Molecular Properties

Compound Name10-hydroxyundec-1-en-6-one
PubChem CID10821365
Molecular FormulaC11H20O2
Molecular Weight184.28 g/mol
Exact Mass184.15
IUPAC Name10-hydroxyundec-1-en-6-one
SMILESC=CCCCC(=O)CCCC(C)O
InChIInChI=1S/C11H20O2/c1-3-4-5-8-11(13)9-6-7-10(2)12/h3,10,12H,1,4-9H2,2H3
InChIKeyQOQZFWWLTAMSDW-UHFFFAOYSA-N
XLogP2.46
TPSA37.30 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.28
LogP ≤ 52.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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

1,3-Dihydroxy-8-decen-5-one
CID 5283272
(Z)-1-hydroxyhexadec-10-en-7-one
CID 13964640
1,3-Dihydroxydec-8-en-5-one
CID 336434
(-)-(3R,8E)-1,3-Dihydroxy-8-decen-5-one
CID 10987002
(37S)-37-hydroxyhexatetracont-1-en-15-one
CID 163006727
7-Hydroxyoct-1-en-3-one
CID 21501158
1,3-Dihydroxy-8-decen-5-one; Streptenol-A
CID 5384628
7-Oxo-11-dodecen-3-ol
CID 14752697
7-Hydroxy-1-nonen-3-one
CID 20362369
Disparalone
CID 6161032
11-Hydroxyicosa-1,19-dien-10-one
CID 10946786
37-Hydroxyhexatetracont-1-en-15-one
CID 15714517

Frequently Asked Questions

What is the IUPAC name of 10-hydroxyundec-1-en-6-one?
The IUPAC name of 10-hydroxyundec-1-en-6-one (CID 10821365) is 10-hydroxyundec-1-en-6-one.
What is the SMILES notation for 10-hydroxyundec-1-en-6-one?
The canonical SMILES for 10-hydroxyundec-1-en-6-one is C=CCCCC(=O)CCCC(C)O.
What is the InChIKey of 10-hydroxyundec-1-en-6-one?
The InChIKey is QOQZFWWLTAMSDW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20O2/c1-3-4-5-8-11(13)9-6-7-10(2)12/h3,10,12H,1,4-9H2,2H3.
What are the key properties of 10-hydroxyundec-1-en-6-one?
10-hydroxyundec-1-en-6-one has a molecular weight of 184.28 g/mol, XLogP of 2.46, 8 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 10-hydroxyundec-1-en-6-one is sourced from PubChem (CID 10821365), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).