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20380-97-6

20380-97-6 | Benzenebutanamide, 3,4-dichloro-N-(3-hydroxypropyl)-γ-oxo-

CAS No: 20380-97-6 Catalog No: AG00294B MDL No:

Product Description

Catalog Number:
AG00294B
Chemical Name:
Benzenebutanamide, 3,4-dichloro-N-(3-hydroxypropyl)-γ-oxo-
CAS Number:
20380-97-6
Molecular Formula:
C13H15Cl2NO3
Molecular Weight:
304.1691
IUPAC Name:
4-(3,4-dichlorophenyl)-N-(3-hydroxypropyl)-4-oxobutanamide
InChI:
InChI=1S/C13H15Cl2NO3/c14-10-3-2-9(8-11(10)15)12(18)4-5-13(19)16-6-1-7-17/h2-3,8,17H,1,4-7H2,(H,16,19)
InChI Key:
GRFXQBDJLYRHGA-UHFFFAOYSA-N
SMILES:
OCCCNC(=O)CCC(=O)c1ccc(c(c1)Cl)Cl

Properties

Complexity:
312  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
303.043g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
304.167g/mol
Monoisotopic Mass:
303.043g/mol
Rotatable Bond Count:
7  
Topological Polar Surface Area:
66.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7  

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