Home Nitros 2-hydroxy-3-methoxy-4-nitrobenzoic acid

2-hydroxy-3-methoxy-4-nitrobenzoic acid

CAS No.:
61203-50-7
Catalog Number:
AG01BG77
Molecular Formula:
C8H7NO6
Molecular Weight:
213.1443
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Product Description
Catalog Number:
AG01BG77
Chemical Name:
2-hydroxy-3-methoxy-4-nitrobenzoic acid
CAS Number:
61203-50-7
Molecular Formula:
C8H7NO6
Molecular Weight:
213.1443
MDL Number:
MFCD28118856
IUPAC Name:
2-hydroxy-3-methoxy-4-nitrobenzoic acid
InChI:
InChI=1S/C8H7NO6/c1-15-7-5(9(13)14)3-2-4(6(7)10)8(11)12/h2-3,10H,1H3,(H,11,12)
InChI Key:
GWMPFGBRRHGDRA-UHFFFAOYSA-N
SMILES:
COc1c(O)c(ccc1[N+](=O)[O-])C(=O)O
Properties
Complexity:
262  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
213.027g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
213.145g/mol
Monoisotopic Mass:
213.027g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
113A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4  
Properties