Home Other Building Blocks 2-HYDROXY-2-(1-METHYL-1H-PYRAZOL-5-YL)ACETIC ACID

2-HYDROXY-2-(1-METHYL-1H-PYRAZOL-5-YL)ACETIC ACID

CAS No.:
1480480-82-7
Catalog Number:
AG01EK7H
Molecular Formula:
C6H8N2O3
Molecular Weight:
156.1393
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Product Description
Catalog Number:
AG01EK7H
Chemical Name:
2-HYDROXY-2-(1-METHYL-1H-PYRAZOL-5-YL)ACETIC ACID
CAS Number:
1480480-82-7
Molecular Formula:
C6H8N2O3
Molecular Weight:
156.1393
MDL Number:
MFCD20868623
IUPAC Name:
2-hydroxy-2-(2-methylpyrazol-3-yl)acetic acid
InChI:
InChI=1S/C6H8N2O3/c1-8-4(2-3-7-8)5(9)6(10)11/h2-3,5,9H,1H3,(H,10,11)
InChI Key:
RPSNVJPNLVMWDD-UHFFFAOYSA-N
SMILES:
Cn1nccc1C(C(=O)O)O
Properties
Complexity:
162  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
156.053g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
156.141g/mol
Monoisotopic Mass:
156.053g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
75.4A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.8  
Properties