Home Carboxys 2-(3-nitrophenyl)cyclopropane-1-carboxylic acid, Mixture of diastereomers

2-(3-nitrophenyl)cyclopropane-1-carboxylic acid, Mixture of diastereomers

CAS No.:
91880-89-6
Catalog Number:
AG01BRG1
Molecular Formula:
C10H9NO4
Molecular Weight:
207.1828
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Product Description
Catalog Number:
AG01BRG1
Chemical Name:
2-(3-nitrophenyl)cyclopropane-1-carboxylic acid, Mixture of diastereomers
CAS Number:
91880-89-6
Molecular Formula:
C10H9NO4
Molecular Weight:
207.1828
MDL Number:
MFCD12068254
IUPAC Name:
2-(3-nitrophenyl)cyclopropane-1-carboxylic acid
InChI:
InChI=1S/C10H9NO4/c12-10(13)9-5-8(9)6-2-1-3-7(4-6)11(14)15/h1-4,8-9H,5H2,(H,12,13)
InChI Key:
MZCREXORTQFYPP-UHFFFAOYSA-N
SMILES:
OC(=O)C1CC1c1cccc(c1)[N+](=O)[O-]
Properties
Complexity:
286  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
207.053g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
207.185g/mol
Monoisotopic Mass:
207.053g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
83.1A^2
Undefined Atom Stereocenter Count:
2  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5  
Properties