(2-methyl-3-phenylcycloprop-2-en-1-yl)methanol

C11H12O — CID 71325924

IUPAC(2-methyl-3-phenylcycloprop-2-en-1-yl)methanol
SMILESCC1=C(c2ccccc2)C1CO
InChIInChI=1S/C11H12O/c1-8-10(7-12)11(8)9-5-3-2-4-6-9/h2-6,10,12H,7H2,1H3
InChIKeyGYZARZPIPJVAIO-UHFFFAOYSA-N
MW160.22 g/mol
LogP2.08
Rot. Bonds2

About (2-methyl-3-phenylcycloprop-2-en-1-yl)methanol

(2-methyl-3-phenylcycloprop-2-en-1-yl)methanol (PubChem CID 71325924) has the molecular formula C11H12O and a molecular weight of 160.22 g/mol. Its IUPAC name is (2-methyl-3-phenylcycloprop-2-en-1-yl)methanol.

Molecular Properties

Compound Name(2-methyl-3-phenylcycloprop-2-en-1-yl)methanol
PubChem CID71325924
Molecular FormulaC11H12O
Molecular Weight160.22 g/mol
Exact Mass160.09
IUPAC Name(2-methyl-3-phenylcycloprop-2-en-1-yl)methanol
SMILESCC1=C(c2ccccc2)C1CO
InChIInChI=1S/C11H12O/c1-8-10(7-12)11(8)9-5-3-2-4-6-9/h2-6,10,12H,7H2,1H3
InChIKeyGYZARZPIPJVAIO-UHFFFAOYSA-N
XLogP2.08
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500160.22
LogP ≤ 52.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of (2-methyl-3-phenylcycloprop-2-en-1-yl)methanol?
The IUPAC name of (2-methyl-3-phenylcycloprop-2-en-1-yl)methanol (CID 71325924) is (2-methyl-3-phenylcycloprop-2-en-1-yl)methanol.
What is the SMILES notation for (2-methyl-3-phenylcycloprop-2-en-1-yl)methanol?
The canonical SMILES for (2-methyl-3-phenylcycloprop-2-en-1-yl)methanol is CC1=C(c2ccccc2)C1CO.
What is the InChIKey of (2-methyl-3-phenylcycloprop-2-en-1-yl)methanol?
The InChIKey is GYZARZPIPJVAIO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12O/c1-8-10(7-12)11(8)9-5-3-2-4-6-9/h2-6,10,12H,7H2,1H3.
What are the key properties of (2-methyl-3-phenylcycloprop-2-en-1-yl)methanol?
(2-methyl-3-phenylcycloprop-2-en-1-yl)methanol has a molecular weight of 160.22 g/mol, XLogP of 2.08, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2-methyl-3-phenylcycloprop-2-en-1-yl)methanol is sourced from PubChem (CID 71325924), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).