Home Carboxes 102732-63-8
102732-63-8,MFCD03161180
Catalog No.:AA00086G
102732-63-8 | 2-(1H-Pyrazol-3-yl)acetic acid
Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
97%
in stock  
$362.00   $253.00
- +
  • Technical Information
  • Properties
  • Literature
  • Request for Quotation
  • Q & A
  • Technical Information
  • Properties
  • Literature
Technical Information
Catalog Number:
AA00086G
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
Computed 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  

Synonyms
 
102732-63-8 
2-(1H-Pyrazol-3-yl)acetic acid 
SCHEMBL1321921 
CTK0D8923 
DTXSID90542641 
NTVKSUPEUFXUGS-UHFFFAOYSA-N 
CS-D0159 
1006AJ 
MFCD03161180 
ZINC20417336 
AKOS005362498 
AKOS006240983 
1H-Pyrazole-3-acetic acid 
MCULE-6168707042 
NE63084 
SB12474 
AC-25634 
AJ-77412 
SC-21485 
FT-0749017 
ST24039085 
C5H6N2O2 
ACN-044818 
2-(1H-PYRAZOL-5-YL)ACETIC ACID 
2-(1H-Pyrazol-3-yl)acetic acid hydrochloride 
(1H-Pyrazol-3-yl)-acetic acid 
(1H-Pyrazol-5-yl)acetic acid 
pyrazoleacetic acid 
3-Pyrazolylacetic acid 
ACMC-20m5p9 
1H-Pyrazol-3-ylacetic acid 
Literature
Quotation Request
Company Name:
*
Contact Person:
*
Email:
*
Quantity Required:
*
Additional Info:
Q & A