2-methyl-3-phenylprop-2-en-1-ol

C10H12O — CID 560879

IUPAC2-methyl-3-phenylprop-2-en-1-ol
SMILESCC(=Cc1ccccc1)CO
InChIInChI=1S/C10H12O/c1-9(8-11)7-10-5-3-2-4-6-10/h2-7,11H,8H2,1H3
InChIKeyLLNAMUJRIZIXHF-UHFFFAOYSA-N
MW148.20 g/mol
LogP2.08
Rot. Bonds2

About 2-methyl-3-phenylprop-2-en-1-ol

2-methyl-3-phenylprop-2-en-1-ol (PubChem CID 560879) has the molecular formula C10H12O and a molecular weight of 148.20 g/mol. Its IUPAC name is 2-methyl-3-phenylprop-2-en-1-ol.

Molecular Properties

Compound Name2-methyl-3-phenylprop-2-en-1-ol
PubChem CID560879
Molecular FormulaC10H12O
Molecular Weight148.20 g/mol
Exact Mass148.09
IUPAC Name2-methyl-3-phenylprop-2-en-1-ol
SMILESCC(=Cc1ccccc1)CO
InChIInChI=1S/C10H12O/c1-9(8-11)7-10-5-3-2-4-6-10/h2-7,11H,8H2,1H3
InChIKeyLLNAMUJRIZIXHF-UHFFFAOYSA-N
XLogP2.08
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500148.20
LogP ≤ 52.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

Benzyl Alcohol
CID 244
Cinnamyl Alcohol
CID 5315892
1-Phenylethanol
CID 7409
1-Phenyl-1-propanol
CID 7147
4-Methylbenzyl alcohol
CID 11505
Benzenepropanol
CID 31234
1-Phenylethanol, (R)-
CID 637516
3-Methylbenzyl alcohol
CID 11476
4-Phenyl-2-butanol
CID 61302
2-Pentylcinnamic alcohol
CID 5368491
1-Phenylethanol, (S)-
CID 443135
3-Phenylprop-2-En-1-Ol
CID 308

Frequently Asked Questions

What is the IUPAC name of 2-methyl-3-phenylprop-2-en-1-ol?
The IUPAC name of 2-methyl-3-phenylprop-2-en-1-ol (CID 560879) is 2-methyl-3-phenylprop-2-en-1-ol.
What is the SMILES notation for 2-methyl-3-phenylprop-2-en-1-ol?
The canonical SMILES for 2-methyl-3-phenylprop-2-en-1-ol is CC(=Cc1ccccc1)CO.
What is the InChIKey of 2-methyl-3-phenylprop-2-en-1-ol?
The InChIKey is LLNAMUJRIZIXHF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12O/c1-9(8-11)7-10-5-3-2-4-6-10/h2-7,11H,8H2,1H3.
What are the key properties of 2-methyl-3-phenylprop-2-en-1-ol?
2-methyl-3-phenylprop-2-en-1-ol has a molecular weight of 148.20 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-phenylprop-2-en-1-ol is sourced from PubChem (CID 560879), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).