Anisacril
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Basic information
- CAS
5129-14-6- Standard SMILES
COc1ccccc1C(C(=O)O)=C(c1ccccc1)c1ccccc1- InChIKey
RHDBQQXIWBILRU-UHFFFAOYSA-N- Molecular formula
- C22H18O3
- Average molar mass
- 330.4 g/mol
- Monoisotopic mass
- 330.12559443
Overview
Anisacril is a small molecule drug. Anisacril has a monoisotopic molecular weight of 330.13 Da.
Names & identifiers
- Preferred name
- Anisacril
- IUPAC
- 2-(2-methoxyphenyl)-3,3-diphenylprop-2-enoic acid
- English name
- Anisacril
- Molecular formula
- C22H18O3
- Molecular weight
- 330.38
Names & synonyms
ANISACRILAnisacriloAnisacril [INN]Anisacrilum5129-14-6SKF 16046UNII-5TB1FV429Z5TB1FV429ZSKF-160462-(2-Methoxyphenyl)-3,3-diphenylacrylsaeure2-(o-Methoxyphenyl)-3,3-diphenylacryic acidDTXSID60199282
Show more names
α-(o-Anisyl)-β,β-diphenylacrylsaeure2-(2-methoxyphenyl)-3,3-di(phenyl)acrylic acid2-(2-methoxyphenyl)-3,3-di(phenyl)prop-2-enoic acidBenzeneacetic acid, α-(diphenylmethylene)-2-methoxy-2-(2-methoxyphenyl)-3,3-diphenylacrylic acid(WXG02282)
2-(o-Methoxyphenyl)-3,3-diphenyl acrylic acidAcrylic acid, 2-(o-Methoxyphenyl)-3,3-diphenyl-RefChem:112826DTXCID901217732-(2-methoxyphenyl)-3,3-diphenylprop-2-enoic acidSCHEMBL1817955CHEMBL2104547NS00124974
Database identifiers
- CAS
5129-14-6- PubChem CID
- 21203
- DTXSID
DTXSID60199282- ChEMBL
CHEMBL2104547- UNII
- 5TB1FV429Z
Properties
Computed structural propertiesFilling in
- XLogP
- 5.4
- Topological polar surface area
- 46.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 5
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 450
Physicochemical properties
- FDA UNII
- 5 TB1FV429Z · 5TB1FV429Z
Chemistry & industry
Upstream & downstream products
Upstream raw materials
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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