1-(4-methylphenyl)prop-2-en-1-ol

C10H12O — CID 10931590

IUPAC1-(4-methylphenyl)prop-2-en-1-ol
SMILESC=CC(O)c1ccc(C)cc1
InChIInChI=1S/C10H12O/c1-3-10(11)9-6-4-8(2)5-7-9/h3-7,10-11H,1H2,2H3
InChIKeyFYIVKNAQOIFBQW-UHFFFAOYSA-N
MW148.20 g/mol
LogP2.21
Rot. Bonds2

About 1-(4-methylphenyl)prop-2-en-1-ol

1-(4-methylphenyl)prop-2-en-1-ol (PubChem CID 10931590) has the molecular formula C10H12O and a molecular weight of 148.20 g/mol. Its IUPAC name is 1-(4-methylphenyl)prop-2-en-1-ol.

Molecular Properties

Compound Name1-(4-methylphenyl)prop-2-en-1-ol
PubChem CID10931590
Molecular FormulaC10H12O
Molecular Weight148.20 g/mol
Exact Mass148.09
IUPAC Name1-(4-methylphenyl)prop-2-en-1-ol
SMILESC=CC(O)c1ccc(C)cc1
InChIInChI=1S/C10H12O/c1-3-10(11)9-6-4-8(2)5-7-9/h3-7,10-11H,1H2,2H3
InChIKeyFYIVKNAQOIFBQW-UHFFFAOYSA-N
XLogP2.21
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 ≤ 52.21
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

(2S)-2-hydroxy-2-(4-methylphenyl)acetaldehyde
CID 130026128
(1S)-1-(4-bromophenyl)prop-2-en-1-ol
CID 25140431
benzene;1-phenylprop-2-en-1-ol
CID 174884403
(E)-1-(4-methylphenyl)but-2-en-1-ol
CID 10866652
1-(4-propylphenyl)prop-2-en-1-ol
CID 83635929
1-but-3-en-2-yl-4-methylbenzene;ruthenium
CID 175031395
1-(2-fluoro-4-methylphenyl)prop-2-en-1-ol
CID 115814697
(E,1S)-4,4-dimethyl-1-(4-methylphenyl)pent-2-en-1-ol;ethane;zinc
CID 11289501
(E)-1-(4-methylphenyl)but-2-ene-1,4-diol
CID 70488994
4-methyl-1-(4-methylphenyl)penta-2,3-dien-1-ol
CID 130125593
ethane;1-methyl-4-(4-methylpent-1-en-3-yl)benzene
CID 142124188
1-(4-butan-2-yloxyphenyl)prop-2-en-1-ol
CID 139885484

Frequently Asked Questions

What is the IUPAC name of 1-(4-methylphenyl)prop-2-en-1-ol?
The IUPAC name of 1-(4-methylphenyl)prop-2-en-1-ol (CID 10931590) is 1-(4-methylphenyl)prop-2-en-1-ol.
What is the SMILES notation for 1-(4-methylphenyl)prop-2-en-1-ol?
The canonical SMILES for 1-(4-methylphenyl)prop-2-en-1-ol is C=CC(O)c1ccc(C)cc1.
What is the InChIKey of 1-(4-methylphenyl)prop-2-en-1-ol?
The InChIKey is FYIVKNAQOIFBQW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12O/c1-3-10(11)9-6-4-8(2)5-7-9/h3-7,10-11H,1H2,2H3.
What are the key properties of 1-(4-methylphenyl)prop-2-en-1-ol?
1-(4-methylphenyl)prop-2-en-1-ol has a molecular weight of 148.20 g/mol, XLogP of 2.21, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-methylphenyl)prop-2-en-1-ol is sourced from PubChem (CID 10931590), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).