N-(5-chloro-2-methylphenyl)-3-oxobutanamide
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Basic information
- CAS
25233-50-5- Standard SMILES
CC(=O)CC(=O)Nc1cc(Cl)ccc1C- InChIKey
SGUFPRJAMBWKAZ-UHFFFAOYSA-N- Molecular formula
- C11H12ClNO2
- Average molar mass
- 225.67 g/mol
- Monoisotopic mass
- 225.0556563
Names & identifiers
- Preferred name
- N-(5-chloro-2-methylphenyl)-3-oxobutanamide
- IUPAC
- N-(5-chloro-2-methylphenyl)-3-oxobutanamide
- English name
- N-(5-CHLORO-2-METHYL-PHENYL)-3-OXO-BUTYRAMIDE
- Molecular formula
- C11H12ClNO2
- Molecular weight
- 225.67
Names & synonyms
N-(5-chloro-2-methylphenyl)-3-oxobutanamide25233-50-5N-(5-Chloro-2-methyl-phenyl)-3-oxo-butyramideNSC 165879NSC165879CBMicro_045289Butanamide, N-(5-chloro-2-methylphenyl)-3-oxo-SCHEMBL9181550Acetoacet-5-chloro-2-toluidideDTXSID70304481MFCD00018744SBB076287
Show more names
STL081010AKOS000115196NSC-1658795'-CHLORO-ORTHO-ACETOACETOTOLUIDIDEBIM-0045147.P001CS-0218593ST50443502EN300-01445
Database identifiers
- CAS
25233-50-5- PubChem CID
- 296090
- DTXSID
DTXSID70304481- Nikkaji
- J153.418A
Properties
Computed structural propertiesFilling in
- XLogP
- 2.3
- Topological polar surface area
- 46.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 255
Related reactions
0 records
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Compound notes
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