(E)-3-(2,4-dimethoxyphenyl)-3-phenylprop-2-en-1-ol

C17H18O3 — CID 101049410

IUPAC(E)-3-(2,4-dimethoxyphenyl)-3-phenylprop-2-en-1-ol
SMILESCOc1ccc(/C(=C/CO)c2ccccc2)c(OC)c1
InChIInChI=1S/C17H18O3/c1-19-14-8-9-16(17(12-14)20-2)15(10-11-18)13-6-4-3-5-7-13/h3-10,12,18H,11H2,1-2H3/b15-10+
InChIKeyJHJUQPCJLGABKU-XNTDXEJSSA-N
MW270.33 g/mol
LogP3.13
Rot. Bonds5

About (E)-3-(2,4-dimethoxyphenyl)-3-phenylprop-2-en-1-ol

(E)-3-(2,4-dimethoxyphenyl)-3-phenylprop-2-en-1-ol (PubChem CID 101049410) has the molecular formula C17H18O3 and a molecular weight of 270.33 g/mol. Its IUPAC name is (E)-3-(2,4-dimethoxyphenyl)-3-phenylprop-2-en-1-ol.

Molecular Properties

Compound Name(E)-3-(2,4-dimethoxyphenyl)-3-phenylprop-2-en-1-ol
PubChem CID101049410
Molecular FormulaC17H18O3
Molecular Weight270.33 g/mol
Exact Mass270.13
IUPAC Name(E)-3-(2,4-dimethoxyphenyl)-3-phenylprop-2-en-1-ol
SMILESCOc1ccc(/C(=C/CO)c2ccccc2)c(OC)c1
InChIInChI=1S/C17H18O3/c1-19-14-8-9-16(17(12-14)20-2)15(10-11-18)13-6-4-3-5-7-13/h3-10,12,18H,11H2,1-2H3/b15-10+
InChIKeyJHJUQPCJLGABKU-XNTDXEJSSA-N
XLogP3.13
TPSA38.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.33
LogP ≤ 53.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

chloro-[(E)-2-(2,4-dimethoxyphenyl)-2-phenylethenyl]mercury
CID 10600620
1,4-dimethoxy-2-[(E)-1-phenylprop-1-enyl]benzene
CID 102370228
1,4-dimethoxy-2-[(Z)-1-phenylprop-1-enyl]benzene
CID 102082357
2,4-dimethoxybenzoic acid
CID 7052
2,4-dimethoxybenzoic acid
CID 67450326
N,N-diethyl-3-methoxy-4-(1-phenylbuta-1,3-dienyl)aniline
CID 139761075
2-(2,4-dimethoxyphenyl)-1-phenylethanone
CID 10467591
2-(N-ethyl-C-phenylcarbonimidoyl)-5-methoxyphenol
CID 136832737
(Z)-3-[4-(bromomethyl)-2-methoxyphenyl]-3-phenylprop-2-enal
CID 143730937
3-amino-1-(2,4-dimethoxyphenyl)propan-1-one
CID 93183350
[2-(2,4-dimethoxyphenyl)-2-oxoethyl] 3-(2-methoxyphenyl)-2-phenylprop-2-enoate
CID 5183155
2-anilino-1-(2,4-dimethoxyphenyl)ethanone
CID 94281074

Frequently Asked Questions

What is the IUPAC name of (E)-3-(2,4-dimethoxyphenyl)-3-phenylprop-2-en-1-ol?
The IUPAC name of (E)-3-(2,4-dimethoxyphenyl)-3-phenylprop-2-en-1-ol (CID 101049410) is (E)-3-(2,4-dimethoxyphenyl)-3-phenylprop-2-en-1-ol.
What is the SMILES notation for (E)-3-(2,4-dimethoxyphenyl)-3-phenylprop-2-en-1-ol?
The canonical SMILES for (E)-3-(2,4-dimethoxyphenyl)-3-phenylprop-2-en-1-ol is COc1ccc(/C(=C/CO)c2ccccc2)c(OC)c1.
What is the InChIKey of (E)-3-(2,4-dimethoxyphenyl)-3-phenylprop-2-en-1-ol?
The InChIKey is JHJUQPCJLGABKU-XNTDXEJSSA-N. The full InChI is InChI=1S/C17H18O3/c1-19-14-8-9-16(17(12-14)20-2)15(10-11-18)13-6-4-3-5-7-13/h3-10,12,18H,11H2,1-2H3/b15-10+.
What are the key properties of (E)-3-(2,4-dimethoxyphenyl)-3-phenylprop-2-en-1-ol?
(E)-3-(2,4-dimethoxyphenyl)-3-phenylprop-2-en-1-ol has a molecular weight of 270.33 g/mol, XLogP of 3.13, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-3-(2,4-dimethoxyphenyl)-3-phenylprop-2-en-1-ol is sourced from PubChem (CID 101049410), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).