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1005582-20-6,MFCD03419650
Catalog No.:AA00028P
1005582-20-6 | 2-(4-Methyl-1h-pyrazol-1-yl)propanoic acid
Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
95%
in stock  
$156.00   $109.00
- +
5g
95%
in stock  
$472.00   $330.00
- +
  • Technical Information
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  • Q & A
  • Technical Information
  • Properties
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Technical Information
Catalog Number:
AA00028P
Chemical Name:
2-(4-Methyl-1h-pyrazol-1-yl)propanoic acid
CAS Number:
1005582-20-6
Molecular Formula:
C7H10N2O2
Molecular Weight:
154.1665
MDL Number:
MFCD03419650
IUPAC Name:
2-(4-methylpyrazol-1-yl)propanoic acid
InChI:
InChI=1S/C7H10N2O2/c1-5-3-8-9(4-5)6(2)7(10)11/h3-4,6H,1-2H3,(H,10,11)
InChI Key:
SZJMPHMZGHRQRZ-UHFFFAOYSA-N
SMILES:
CC(n1cc(cn1)C)C(=O)O
Properties
Computed 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:
0.7  

Synonyms
 
2-(4-methyl-1H-pyrazol-1-yl)propanoic acid 
1005582-20-6 
MFCD03419650 
SBB020459 
STK312270 
AKOS000308231 
MCULE-4851903758 
BB 0240305 
FT-0679143 
ST45091305 
EN300-83579 
1H-Pyrazole-1-acetic acid, alpha,4-dimethyl- 
2-(4-methylpyrazol-1-yl)propanoic acid 
Y-0385 
I04-4545 
2-(4-methyl-pyrazol-1-yl)-propionic acid, AldrichCPR 
Z1650189077 
C7H10N2O2 
2-(4-methylpyrazolyl)propanoic acid 
2-(4-Methyl-pyrazol-1-yl)-propionic acid 
SCHEMBL15601821 
CTK3J9070 
DTXSID00588671 
ALBB-005837 
7192AC 
Literature
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