(Z)-4-(2-methylphenyl)but-3-en-1-ol

C11H14O — CID 117268056

IUPAC(Z)-4-(2-methylphenyl)but-3-en-1-ol
SMILESCc1ccccc1/C=C\CCO
InChIInChI=1S/C11H14O/c1-10-6-2-3-7-11(10)8-4-5-9-12/h2-4,6-8,12H,5,9H2,1H3/b8-4-
InChIKeyXNBYMDXNLPJGGE-YWEYNIOJSA-N
MW162.23 g/mol
LogP2.39
Rot. Bonds3

About (Z)-4-(2-methylphenyl)but-3-en-1-ol

(Z)-4-(2-methylphenyl)but-3-en-1-ol (PubChem CID 117268056) has the molecular formula C11H14O and a molecular weight of 162.23 g/mol. Its IUPAC name is (Z)-4-(2-methylphenyl)but-3-en-1-ol.

Molecular Properties

Compound Name(Z)-4-(2-methylphenyl)but-3-en-1-ol
PubChem CID117268056
Molecular FormulaC11H14O
Molecular Weight162.23 g/mol
Exact Mass162.10
IUPAC Name(Z)-4-(2-methylphenyl)but-3-en-1-ol
SMILESCc1ccccc1/C=C\CCO
InChIInChI=1S/C11H14O/c1-10-6-2-3-7-11(10)8-4-5-9-12/h2-4,6-8,12H,5,9H2,1H3/b8-4-
InChIKeyXNBYMDXNLPJGGE-YWEYNIOJSA-N
XLogP2.39
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500162.23
LogP ≤ 52.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of (Z)-4-(2-methylphenyl)but-3-en-1-ol?
The IUPAC name of (Z)-4-(2-methylphenyl)but-3-en-1-ol (CID 117268056) is (Z)-4-(2-methylphenyl)but-3-en-1-ol.
What is the SMILES notation for (Z)-4-(2-methylphenyl)but-3-en-1-ol?
The canonical SMILES for (Z)-4-(2-methylphenyl)but-3-en-1-ol is Cc1ccccc1/C=C\CCO.
What is the InChIKey of (Z)-4-(2-methylphenyl)but-3-en-1-ol?
The InChIKey is XNBYMDXNLPJGGE-YWEYNIOJSA-N. The full InChI is InChI=1S/C11H14O/c1-10-6-2-3-7-11(10)8-4-5-9-12/h2-4,6-8,12H,5,9H2,1H3/b8-4-.
What are the key properties of (Z)-4-(2-methylphenyl)but-3-en-1-ol?
(Z)-4-(2-methylphenyl)but-3-en-1-ol has a molecular weight of 162.23 g/mol, XLogP of 2.39, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-4-(2-methylphenyl)but-3-en-1-ol is sourced from PubChem (CID 117268056), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).