Home Other Building Blocks 2-(1-methyl-1H-pyrazol-4-yl)propanoic acid

2-(1-methyl-1H-pyrazol-4-yl)propanoic acid

CAS No.:
1248781-46-5
Catalog Number:
AG019YEC
Molecular Formula:
C7H10N2O2
Molecular Weight:
154.1665
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Product Description
Catalog Number:
AG019YEC
Chemical Name:
2-(1-methyl-1H-pyrazol-4-yl)propanoic acid
CAS Number:
1248781-46-5
Molecular Formula:
C7H10N2O2
Molecular Weight:
154.1665
MDL Number:
MFCD16109187
IUPAC Name:
2-(1-methylpyrazol-4-yl)propanoic acid
InChI:
InChI=1S/C7H10N2O2/c1-5(7(10)11)6-3-8-9(2)4-6/h3-5H,1-2H3,(H,10,11)
InChI Key:
RAVRFCWUMKSDAN-UHFFFAOYSA-N
SMILES:
OC(=O)C(c1cnn(c1)C)C
Properties
Complexity:
161  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
154.074g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
154.169g/mol
Monoisotopic Mass:
154.074g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
55.1A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
0.3  
Properties