Home Nitros Butanoic acid, 4-nitro-

Butanoic acid, 4-nitro-

CAS No.:
16488-43-0
Catalog Number:
AG001V3S
Molecular Formula:
C4H7NO4
Molecular Weight:
133.1027
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Product Description
Catalog Number:
AG001V3S
Chemical Name:
Butanoic acid, 4-nitro-
CAS Number:
16488-43-0
Molecular Formula:
C4H7NO4
Molecular Weight:
133.1027
MDL Number:
MFCD17013393
IUPAC Name:
4-nitrobutanoic acid
InChI:
InChI=1S/C4H7NO4/c6-4(7)2-1-3-5(8)9/h1-3H2,(H,6,7)
InChI Key:
SUFKNMKUIYHURJ-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)CCCC(=O)O
Properties
Complexity:
116  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
133.038g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
133.103g/mol
Monoisotopic Mass:
133.038g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
83.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.1  
Literature
Title Journal
Schisandrin B as a hormetic agent for preventing age-related neurodegenerative diseases. Oxidative medicine and cellular longevity 20120101
The effect of a Glu370Asp mutation in glutaryl-CoA dehydrogenase on proton transfer to the dienolate intermediate. Biochemistry 20071218
The McLafferty rearrangement: a personal recollection. Journal of the American Society for Mass Spectrometry 20040701
Properties