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121513-35-7 | Butanamide, 4-chloro-N-(2,4,6-trimethylphenyl)-
CAS No: 121513-35-7 Catalog No: AG00154F MDL No:MFCD03361718
Product Description
Catalog Number:
AG00154F
Chemical Name:
Butanamide, 4-chloro-N-(2,4,6-trimethylphenyl)-
CAS Number:
121513-35-7
Molecular Formula:
C13H18ClNO
Molecular Weight:
239.7411
MDL Number:
MFCD03361718
IUPAC Name:
4-chloro-N-(2,4,6-trimethylphenyl)butanamide
InChI:
InChI=1S/C13H18ClNO/c1-9-7-10(2)13(11(3)8-9)15-12(16)5-4-6-14/h7-8H,4-6H2,1-3H3,(H,15,16)
InChI Key:
JLSHBNHLTMDYRK-UHFFFAOYSA-N
SMILES:
ClCCCC(=O)Nc1c(C)cc(cc1C)C
Properties
Complexity:
220
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
239.108g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
239.743g/mol
Monoisotopic Mass:
239.108g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
29.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1
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