Home Nitros 4-Chloro-N-(3-nitrophenyl)butanamide

4-Chloro-N-(3-nitrophenyl)butanamide

CAS No.:
304684-54-6
Catalog Number:
AG00I5PY
Molecular Formula:
C10H11ClN2O3
Molecular Weight:
242.6589
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Product Description
Catalog Number:
AG00I5PY
Chemical Name:
4-Chloro-N-(3-nitrophenyl)butanamide
CAS Number:
304684-54-6
Molecular Formula:
C10H11ClN2O3
Molecular Weight:
242.6589
MDL Number:
MFCD01918226
IUPAC Name:
4-chloro-N-(3-nitrophenyl)butanamide
InChI:
InChI=1S/C10H11ClN2O3/c11-6-2-5-10(14)12-8-3-1-4-9(7-8)13(15)16/h1,3-4,7H,2,5-6H2,(H,12,14)
InChI Key:
KNMIIQANYVGPTJ-UHFFFAOYSA-N
SMILES:
ClCCCC(=O)Nc1cccc(c1)[N+](=O)[O-]
Properties
Complexity:
255  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
242.046g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
242.659g/mol
Monoisotopic Mass:
242.046g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
74.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4  
Properties