(5R)-5-methylcyclohex-2-ene-1,2-diol

C7H12O2 — CID 89247529

IUPAC(5R)-5-methylcyclohex-2-ene-1,2-diol
SMILESC[C@@H]1CC=C(O)C(O)C1
InChIInChI=1S/C7H12O2/c1-5-2-3-6(8)7(9)4-5/h3,5,7-9H,2,4H2,1H3/t5-,7?/m1/s1
InChIKeyWEPVQPRQTPCKSQ-FOUAAFFMSA-N
MW128.17 g/mol
LogP1.22
Rot. Bonds

About (5R)-5-methylcyclohex-2-ene-1,2-diol

(5R)-5-methylcyclohex-2-ene-1,2-diol (PubChem CID 89247529) has the molecular formula C7H12O2 and a molecular weight of 128.17 g/mol. Its IUPAC name is (5R)-5-methylcyclohex-2-ene-1,2-diol.

Molecular Properties

Compound Name(5R)-5-methylcyclohex-2-ene-1,2-diol
PubChem CID89247529
Molecular FormulaC7H12O2
Molecular Weight128.17 g/mol
Exact Mass128.08
IUPAC Name(5R)-5-methylcyclohex-2-ene-1,2-diol
SMILESC[C@@H]1CC=C(O)C(O)C1
InChIInChI=1S/C7H12O2/c1-5-2-3-6(8)7(9)4-5/h3,5,7-9H,2,4H2,1H3/t5-,7?/m1/s1
InChIKeyWEPVQPRQTPCKSQ-FOUAAFFMSA-N
XLogP1.22
TPSA40.46 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500128.17
LogP ≤ 51.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (5R)-5-methylcyclohex-2-ene-1,2-diol?
The IUPAC name of (5R)-5-methylcyclohex-2-ene-1,2-diol (CID 89247529) is (5R)-5-methylcyclohex-2-ene-1,2-diol.
What is the SMILES notation for (5R)-5-methylcyclohex-2-ene-1,2-diol?
The canonical SMILES for (5R)-5-methylcyclohex-2-ene-1,2-diol is C[C@@H]1CC=C(O)C(O)C1.
What is the InChIKey of (5R)-5-methylcyclohex-2-ene-1,2-diol?
The InChIKey is WEPVQPRQTPCKSQ-FOUAAFFMSA-N. The full InChI is InChI=1S/C7H12O2/c1-5-2-3-6(8)7(9)4-5/h3,5,7-9H,2,4H2,1H3/t5-,7?/m1/s1.
What are the key properties of (5R)-5-methylcyclohex-2-ene-1,2-diol?
(5R)-5-methylcyclohex-2-ene-1,2-diol has a molecular weight of 128.17 g/mol, XLogP of 1.22, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (5R)-5-methylcyclohex-2-ene-1,2-diol is sourced from PubChem (CID 89247529), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).