Home Carboxys Cyclopropanecarboxylic acid, 2-nitro-, (1R,2R)-rel- (9CI)

Cyclopropanecarboxylic acid, 2-nitro-, (1R,2R)-rel- (9CI)

CAS No.:
22882-43-5
Catalog Number:
AG00BFQ6
Molecular Formula:
C4H5NO4
Molecular Weight:
131.0868
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Product Description
Catalog Number:
AG00BFQ6
Chemical Name:
Cyclopropanecarboxylic acid, 2-nitro-, (1R,2R)-rel- (9CI)
CAS Number:
22882-43-5
Molecular Formula:
C4H5NO4
Molecular Weight:
131.0868
MDL Number:
MFCD11838925
IUPAC Name:
2-nitrocyclopropane-1-carboxylic acid
InChI:
InChI=1S/C4H5NO4/c6-4(7)2-1-3(2)5(8)9/h2-3H,1H2,(H,6,7)
InChI Key:
ZWYGYMZMGJZSMM-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)[C@H]1C[C@@H]1C(=O)O
Properties
Complexity:
160  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
131.022g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
131.087g/mol
Monoisotopic Mass:
131.022g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
83.1A^2
Undefined Atom Stereocenter Count:
2  
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.3  
Properties