Completing data — usually done within a minute
Basic information
- CAS
5430-83-1- Standard SMILES
COC(=O)CCC(=O)Nc1ccccc1- InChIKey
YYOHIHLNZZZABC-UHFFFAOYSA-N- Molecular formula
- C11H13NO3
- Average molar mass
- 207.23 g/mol
- Monoisotopic mass
- 207.08954328
Names & identifiers
- Preferred name
- Methyl 4-anilino-4-oxobutanoate
- IUPAC
- methyl 4-anilino-4-oxobutanoate
Names & synonyms
Methyl 4-anilino-4-oxobutanoate5430-83-1methyl 4-oxo-4-(phenylamino)butanoateMETHYL 3-(PHENYLCARBAMOYL)PROPANOATENSC13430methyl N-phenylsuccinamateTimTec1_002864SCHEMBL3769269SCHEMBL5346635CHEMBL1077313SCHEMBL16161732DTXSID90279622
Show more names
HMS1542C04Methyl 4-anilino-4-oxobutanoate #NSC-13430STK022492N-Phenyl-succinamic acid methyl esterAKOS000490245methyl 3-(N-phenylcarbamoyl)propanoateST039637
Database identifiers
- CAS
5430-83-1- PubChem CID
- 224712
- DTXSID
DTXSID90279622- ChEMBL
CHEMBL1077313
Properties
Computed structural propertiesFilling in
- XLogP
- 0.9
- Topological polar surface area
- 55.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 5
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 222
Chemistry & industry
Suppliers3 total
烟台正信新材料科技有限公司13854547682 13854547682 · [email protected]
安阳鸿蒙新材料有限公司19588588067 · [email protected]
安阳鸿蒙新材料有限公司0372-19588588067 19588588067 · [email protected]
Related reactions
1 records
Compound notes
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