Home Carboxys 3-Methyl-1-propyl-1h-pyrazole-5-carboxylic acid

3-Methyl-1-propyl-1h-pyrazole-5-carboxylic acid

CAS No.:
39658-16-7
Catalog Number:
AG00JHRH
Molecular Formula:
C8H12N2O2
Molecular Weight:
168.1931
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
95%
In Stock USA
United States
$175
- +
1g
95%
In Stock USA
United States
$425
- +
5g
95%
In Stock USA
United States
$1350
- +
10g
95%
In Stock USA
United States
$2025
- +
Product Description
Catalog Number:
AG00JHRH
Chemical Name:
3-Methyl-1-propyl-1h-pyrazole-5-carboxylic acid
CAS Number:
39658-16-7
Molecular Formula:
C8H12N2O2
Molecular Weight:
168.1931
MDL Number:
MFCD08700626
IUPAC Name:
5-methyl-2-propylpyrazole-3-carboxylic acid
InChI:
InChI=1S/C8H12N2O2/c1-3-4-10-7(8(11)12)5-6(2)9-10/h5H,3-4H2,1-2H3,(H,11,12)
InChI Key:
VCTGBSMNCRUPCF-UHFFFAOYSA-N
SMILES:
CCCn1nc(cc1C(=O)O)C
Properties
Complexity:
172  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
168.09g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
168.196g/mol
Monoisotopic Mass:
168.09g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
55.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3  
Properties