Home Other Building Blocks 2-Amino-4-(1h-pyrazol-1-yl)benzoic acid

2-Amino-4-(1h-pyrazol-1-yl)benzoic acid

CAS No.:
1186663-55-7
Catalog Number:
AG003GDV
Molecular Formula:
C10H9N3O2
Molecular Weight:
203.1974
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Product Description
Catalog Number:
AG003GDV
Chemical Name:
2-Amino-4-(1h-pyrazol-1-yl)benzoic acid
CAS Number:
1186663-55-7
Molecular Formula:
C10H9N3O2
Molecular Weight:
203.1974
MDL Number:
MFCD11656802
IUPAC Name:
2-amino-4-pyrazol-1-ylbenzoic acid
InChI:
InChI=1S/C10H9N3O2/c11-9-6-7(13-5-1-4-12-13)2-3-8(9)10(14)15/h1-6H,11H2,(H,14,15)
InChI Key:
MCADMJGMKMNLIE-UHFFFAOYSA-N
SMILES:
OC(=O)c1ccc(cc1N)n1cccn1
Properties
Complexity:
247  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
203.069g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
203.201g/mol
Monoisotopic Mass:
203.069g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
81.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3  
Properties