(1R)-3-methylcyclohex-3-en-1-ol

C7H12O — CID 144556307

IUPAC(1R)-3-methylcyclohex-3-en-1-ol
SMILESCC1=CCC[C@@H](O)C1
InChIInChI=1S/C7H12O/c1-6-3-2-4-7(8)5-6/h3,7-8H,2,4-5H2,1H3/t7-/m1/s1
InChIKeyHKVFKEJBSWJQMU-SSDOTTSWSA-N
MW112.17 g/mol
LogP1.48
Rot. Bonds

About (1R)-3-methylcyclohex-3-en-1-ol

(1R)-3-methylcyclohex-3-en-1-ol (PubChem CID 144556307) has the molecular formula C7H12O and a molecular weight of 112.17 g/mol. Its IUPAC name is (1R)-3-methylcyclohex-3-en-1-ol.

Molecular Properties

Compound Name(1R)-3-methylcyclohex-3-en-1-ol
PubChem CID144556307
Molecular FormulaC7H12O
Molecular Weight112.17 g/mol
Exact Mass112.09
IUPAC Name(1R)-3-methylcyclohex-3-en-1-ol
SMILESCC1=CCC[C@@H](O)C1
InChIInChI=1S/C7H12O/c1-6-3-2-4-7(8)5-6/h3,7-8H,2,4-5H2,1H3/t7-/m1/s1
InChIKeyHKVFKEJBSWJQMU-SSDOTTSWSA-N
XLogP1.48
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500112.17
LogP ≤ 51.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

(4Z)-4,8-dimethylcyclooct-4-ene-1,2-diol
CID 23092826
(1S)-cyclohex-3-ene-1,3-diol
CID 67743763
1,5-dimethylcyclohexene
CID 520362
5-methylcyclooct-5-ene-1,2-diol
CID 68741308
1-methyl-5-[2-(3-methylcyclohex-3-en-1-yl)propan-2-yl]cyclohexene
CID 59720725
(5R)-1-methyl-5-propan-2-ylcyclohexene
CID 91700558
5-(chloromethyl)-1-methylcyclohexene
CID 152729748
(3E,7E)-3,7-dimethyl-11-methylidenecycloundeca-3,7-dien-1-ol
CID 25209926
(E)-2-methyl-3-(3-methylcyclohex-3-en-1-yl)prop-2-enal
CID 91998695
2-(3-methylcyclohex-3-en-1-yl)propan-2-yl hydrogen carbonate
CID 154428049
(3Z)-4-methylcyclooct-3-en-1-ol
CID 23092761
(1S)-2-tert-butyl-5,9,13-trimethylcyclotetradeca-2,8,12-trien-1-ol
CID 91416681

Frequently Asked Questions

What is the IUPAC name of (1R)-3-methylcyclohex-3-en-1-ol?
The IUPAC name of (1R)-3-methylcyclohex-3-en-1-ol (CID 144556307) is (1R)-3-methylcyclohex-3-en-1-ol.
What is the SMILES notation for (1R)-3-methylcyclohex-3-en-1-ol?
The canonical SMILES for (1R)-3-methylcyclohex-3-en-1-ol is CC1=CCC[C@@H](O)C1.
What is the InChIKey of (1R)-3-methylcyclohex-3-en-1-ol?
The InChIKey is HKVFKEJBSWJQMU-SSDOTTSWSA-N. The full InChI is InChI=1S/C7H12O/c1-6-3-2-4-7(8)5-6/h3,7-8H,2,4-5H2,1H3/t7-/m1/s1.
What are the key properties of (1R)-3-methylcyclohex-3-en-1-ol?
(1R)-3-methylcyclohex-3-en-1-ol has a molecular weight of 112.17 g/mol, XLogP of 1.48, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-3-methylcyclohex-3-en-1-ol is sourced from PubChem (CID 144556307), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).