Home Aminos 2-hydroxy-5-{[(propan-2-yl)carbamoyl]amino}benzoic acid

2-hydroxy-5-{[(propan-2-yl)carbamoyl]amino}benzoic acid

CAS No.:
1038255-06-9
Catalog Number:
AG01AKR0
Molecular Formula:
C11H14N2O4
Molecular Weight:
238.2399
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Product Description
Catalog Number:
AG01AKR0
Chemical Name:
2-hydroxy-5-{[(propan-2-yl)carbamoyl]amino}benzoic acid
CAS Number:
1038255-06-9
Molecular Formula:
C11H14N2O4
Molecular Weight:
238.2399
MDL Number:
MFCD11167440
IUPAC Name:
2-hydroxy-5-(propan-2-ylcarbamoylamino)benzoic acid
InChI:
InChI=1S/C11H14N2O4/c1-6(2)12-11(17)13-7-3-4-9(14)8(5-7)10(15)16/h3-6,14H,1-2H3,(H,15,16)(H2,12,13,17)
InChI Key:
BPBFQUIEYLITPP-UHFFFAOYSA-N
SMILES:
CC(NC(=O)Nc1ccc(c(c1)C(=O)O)O)C
Properties
Complexity:
293  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
238.095g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
4  
Isotope Atom Count:
0
Molecular Weight:
238.243g/mol
Monoisotopic Mass:
238.095g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
98.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2  
Properties