Home Nitros 2-Hydroxy-2-(3-nitrophenyl)acetic acid

2-Hydroxy-2-(3-nitrophenyl)acetic acid

CAS No.:
42164-79-4
Catalog Number:
AG00738X
Molecular Formula:
C8H7NO5
Molecular Weight:
197.1449
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Product Description
Catalog Number:
AG00738X
Chemical Name:
2-Hydroxy-2-(3-nitrophenyl)acetic acid
CAS Number:
42164-79-4
Molecular Formula:
C8H7NO5
Molecular Weight:
197.1449
MDL Number:
MFCD00041429
IUPAC Name:
2-hydroxy-2-(3-nitrophenyl)acetic acid
InChI:
InChI=1S/C8H7NO5/c10-7(8(11)12)5-2-1-3-6(4-5)9(13)14/h1-4,7,10H,(H,11,12)
InChI Key:
KNSULVUQBMUBCX-UHFFFAOYSA-N
SMILES:
OC(=O)C(c1cccc(c1)[N+](=O)[O-])O
NSC Number:
10987
Properties
Complexity:
236  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
197.032g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
197.146g/mol
Monoisotopic Mass:
197.032g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
103A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7  
Properties