Home Carbonyls 2-[(methoxycarbonyl)amino]benzoic acid

2-[(methoxycarbonyl)amino]benzoic acid

CAS No.:
6268-38-8
Catalog Number:
AG01AAVV
Molecular Formula:
C9H9NO4
Molecular Weight:
195.1721
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Product Description
Catalog Number:
AG01AAVV
Chemical Name:
2-[(methoxycarbonyl)amino]benzoic acid
CAS Number:
6268-38-8
Molecular Formula:
C9H9NO4
Molecular Weight:
195.1721
MDL Number:
MFCD00584138
IUPAC Name:
2-(methoxycarbonylamino)benzoic acid
InChI:
InChI=1S/C9H9NO4/c1-14-9(13)10-7-5-3-2-4-6(7)8(11)12/h2-5H,1H3,(H,10,13)(H,11,12)
InChI Key:
VRBXNTUDJOJJDK-UHFFFAOYSA-N
SMILES:
COC(=O)Nc1ccccc1C(=O)O
NSC Number:
36249
Properties
Complexity:
229  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
195.053g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
195.174g/mol
Monoisotopic Mass:
195.053g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
75.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3  
Properties