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

C10H12O — CID 67275749

IUPAC1-(4-methylphenyl)prop-1-en-1-ol
SMILESCC=C(O)c1ccc(C)cc1
InChIInChI=1S/C10H12O/c1-3-10(11)9-6-4-8(2)5-7-9/h3-7,11H,1-2H3
InChIKeyDZKVJUZKXHYEKY-UHFFFAOYSA-N
MW148.20 g/mol
LogP2.91
Rot. Bonds1

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

1-(4-methylphenyl)prop-1-en-1-ol (PubChem CID 67275749) has the molecular formula C10H12O and a molecular weight of 148.20 g/mol. Its IUPAC name is 1-(4-methylphenyl)prop-1-en-1-ol.

Molecular Properties

Compound Name1-(4-methylphenyl)prop-1-en-1-ol
PubChem CID67275749
Molecular FormulaC10H12O
Molecular Weight148.20 g/mol
Exact Mass148.09
IUPAC Name1-(4-methylphenyl)prop-1-en-1-ol
SMILESCC=C(O)c1ccc(C)cc1
InChIInChI=1S/C10H12O/c1-3-10(11)9-6-4-8(2)5-7-9/h3-7,11H,1-2H3
InChIKeyDZKVJUZKXHYEKY-UHFFFAOYSA-N
XLogP2.91
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500148.20
LogP ≤ 52.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}

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Related Compounds

1-[(Z)-but-2-en-2-yl]-4-methylbenzene
CID 58843251
1-but-2-en-2-yl-4-methylbenzene
CID 12583115
acetaldehyde;4-methylbenzoic acid
CID 88694515
4-hydroxy-1,4-bis(4-methylphenyl)but-3-ene-1,2-dione
CID 884327
1-methyl-4-[(2Z,6Z)-6-(4-methylphenyl)octa-2,6-dien-3-yl]benzene
CID 10589610
methyl 3-hydroxy-3-(4-methylphenyl)prop-2-enedithioate
CID 137224917
benzene;bis(1,4-xylene)
CID 159472747
4-[(2E,4E)-4-(4-methylphenyl)hexa-2,4-dien-3-yl]phenol
CID 59197895
ethyl 3-hydroxy-3-(4-methylphenyl)prop-2-enoate
CID 71356233
alumane;4-methylbenzoic acid
CID 173230362
indigane;4-methylbenzoic acid
CID 173230327
CID 158355468
CID 158355468

Frequently Asked Questions

What is the IUPAC name of 1-(4-methylphenyl)prop-1-en-1-ol?
The IUPAC name of 1-(4-methylphenyl)prop-1-en-1-ol (CID 67275749) is 1-(4-methylphenyl)prop-1-en-1-ol.
What is the SMILES notation for 1-(4-methylphenyl)prop-1-en-1-ol?
The canonical SMILES for 1-(4-methylphenyl)prop-1-en-1-ol is CC=C(O)c1ccc(C)cc1.
What is the InChIKey of 1-(4-methylphenyl)prop-1-en-1-ol?
The InChIKey is DZKVJUZKXHYEKY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12O/c1-3-10(11)9-6-4-8(2)5-7-9/h3-7,11H,1-2H3.
What are the key properties of 1-(4-methylphenyl)prop-1-en-1-ol?
1-(4-methylphenyl)prop-1-en-1-ol has a molecular weight of 148.20 g/mol, XLogP of 2.91, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-methylphenyl)prop-1-en-1-ol is sourced from PubChem (CID 67275749), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).