(E)-6-methylundec-6-en-5-ol

C12H24O — CID 12536845

IUPAC(E)-6-methylundec-6-en-5-ol
SMILESCCCC/C=C(\C)C(O)CCCC
InChIInChI=1S/C12H24O/c1-4-6-8-9-11(3)12(13)10-7-5-2/h9,12-13H,4-8,10H2,1-3H3/b11-9+
InChIKeyLVLRBTBZCRSUCL-PKNBQFBNSA-N
MW184.32 g/mol
LogP3.67
Rot. Bonds7

About (E)-6-methylundec-6-en-5-ol

(E)-6-methylundec-6-en-5-ol (PubChem CID 12536845) has the molecular formula C12H24O and a molecular weight of 184.32 g/mol. Its IUPAC name is (E)-6-methylundec-6-en-5-ol.

Molecular Properties

Compound Name(E)-6-methylundec-6-en-5-ol
PubChem CID12536845
Molecular FormulaC12H24O
Molecular Weight184.32 g/mol
Exact Mass184.18
IUPAC Name(E)-6-methylundec-6-en-5-ol
SMILESCCCC/C=C(\C)C(O)CCCC
InChIInChI=1S/C12H24O/c1-4-6-8-9-11(3)12(13)10-7-5-2/h9,12-13H,4-8,10H2,1-3H3/b11-9+
InChIKeyLVLRBTBZCRSUCL-PKNBQFBNSA-N
XLogP3.67
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.32
LogP ≤ 53.67
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

Carveol
CID 7438
6-Methyl-5-hepten-2-ol
CID 20745
Carveol, trans-(-)-
CID 94221
Carveol, cis-(-)-
CID 330573
2-Octen-4-ol, (2E)-
CID 5366203
4,8-Dimethyl-3,7-nonadien-2-ol
CID 5365818
Ipsdienol
CID 92301
(+)-cis-Carveol
CID 443177
Isophorol
CID 79016
(+)-trans-Carveol
CID 443178
3-Methyl-6-(1-methylethenyl)-2-cyclohexen-1-ol
CID 527822
(-)-trans-Isopiperitenol
CID 439410

Frequently Asked Questions

What is the IUPAC name of (E)-6-methylundec-6-en-5-ol?
The IUPAC name of (E)-6-methylundec-6-en-5-ol (CID 12536845) is (E)-6-methylundec-6-en-5-ol.
What is the SMILES notation for (E)-6-methylundec-6-en-5-ol?
The canonical SMILES for (E)-6-methylundec-6-en-5-ol is CCCC/C=C(\C)C(O)CCCC.
What is the InChIKey of (E)-6-methylundec-6-en-5-ol?
The InChIKey is LVLRBTBZCRSUCL-PKNBQFBNSA-N. The full InChI is InChI=1S/C12H24O/c1-4-6-8-9-11(3)12(13)10-7-5-2/h9,12-13H,4-8,10H2,1-3H3/b11-9+.
What are the key properties of (E)-6-methylundec-6-en-5-ol?
(E)-6-methylundec-6-en-5-ol has a molecular weight of 184.32 g/mol, XLogP of 3.67, 7 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-6-methylundec-6-en-5-ol is sourced from PubChem (CID 12536845), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).