Home Other Building Blocks 2-(1H-Pyrazol-3-yl)acetic acid

2-(1H-Pyrazol-3-yl)acetic acid

CAS No.:
102732-63-8
Catalog Number:
AG000898
Molecular Formula:
C5H6N2O2
Molecular Weight:
126.1133
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
96%
In Stock USA
United States
$188
- +
1g
96%
In Stock USA
United States
$438
- +
5g
96%
In Stock USA
United States
$1313
- +
Product Description
Catalog Number:
AG000898
Chemical Name:
2-(1H-Pyrazol-3-yl)acetic acid
CAS Number:
102732-63-8
Molecular Formula:
C5H6N2O2
Molecular Weight:
126.1133
MDL Number:
MFCD03161180
IUPAC Name:
2-(1H-pyrazol-5-yl)acetic acid
InChI:
InChI=1S/C5H6N2O2/c8-5(9)3-4-1-2-6-7-4/h1-2H,3H2,(H,6,7)(H,8,9)
InChI Key:
NTVKSUPEUFXUGS-UHFFFAOYSA-N
SMILES:
OC(=O)Cc1cc[nH]n1
Properties
Complexity:
116  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
126.043g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
126.115g/mol
Monoisotopic Mass:
126.043g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
66A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.3  
Properties