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

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

CAS No.:
247583-70-6
Catalog Number:
AG002PCJ
Molecular Formula:
C8H12N2O2
Molecular Weight:
168.1931
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
≥ 96% (HPLC)
1 week
United States
$118
- +
1g
≥ 96% (HPLC)
1 week
United States
$184
- +
5g
≥ 96% (HPLC)
1 week
United States
$740
- +
Product Description
Catalog Number:
AG002PCJ
Chemical Name:
1-Methyl-5-propyl-1h-pyrazole-3-carboxylic acid
CAS Number:
247583-70-6
Molecular Formula:
C8H12N2O2
Molecular Weight:
168.1931
MDL Number:
MFCD04115071
IUPAC Name:
1-methyl-5-propylpyrazole-3-carboxylic acid
InChI:
InChI=1S/C8H12N2O2/c1-3-4-6-5-7(8(11)12)9-10(6)2/h5H,3-4H2,1-2H3,(H,11,12)
InChI Key:
ORGXAHHHNKMEBW-UHFFFAOYSA-N
SMILES:
Cn1nc(cc1CCC)C(=O)O
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