Home Aminos 3-[(cyclopropylcarbamoyl)amino]benzoic acid

3-[(cyclopropylcarbamoyl)amino]benzoic acid

CAS No.:
1146299-29-7
Catalog Number:
AG019WBP
Molecular Formula:
C11H12N2O3
Molecular Weight:
220.2246
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Product Description
Catalog Number:
AG019WBP
Chemical Name:
3-[(cyclopropylcarbamoyl)amino]benzoic acid
CAS Number:
1146299-29-7
Molecular Formula:
C11H12N2O3
Molecular Weight:
220.2246
MDL Number:
MFCD11868512
IUPAC Name:
3-(cyclopropylcarbamoylamino)benzoic acid
InChI:
InChI=1S/C11H12N2O3/c14-10(15)7-2-1-3-9(6-7)13-11(16)12-8-4-5-8/h1-3,6,8H,4-5H2,(H,14,15)(H2,12,13,16)
InChI Key:
GSWYSHNMCULROB-UHFFFAOYSA-N
SMILES:
O=C(Nc1cccc(c1)C(=O)O)NC1CC1
Properties
Complexity:
289  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
220.085g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
220.228g/mol
Monoisotopic Mass:
220.085g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
78.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7  
Properties