Home Carboxys 1-Ethyl-3-isobutyl-1h-pyrazole-5-carboxylic acid

1-Ethyl-3-isobutyl-1h-pyrazole-5-carboxylic acid

CAS No.:
1015845-75-6
Catalog Number:
AG0004VB
Molecular Formula:
C10H16N2O2
Molecular Weight:
196.2462
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$64
- +
5g
95%
In Stock USA
United States
$125
- +
Product Description
Catalog Number:
AG0004VB
Chemical Name:
1-Ethyl-3-isobutyl-1h-pyrazole-5-carboxylic acid
CAS Number:
1015845-75-6
Molecular Formula:
C10H16N2O2
Molecular Weight:
196.2462
MDL Number:
MFCD08059761
IUPAC Name:
2-ethyl-5-(2-methylpropyl)pyrazole-3-carboxylic acid
InChI:
InChI=1S/C10H16N2O2/c1-4-12-9(10(13)14)6-8(11-12)5-7(2)3/h6-7H,4-5H2,1-3H3,(H,13,14)
InChI Key:
DZGHINKQRGJIHM-UHFFFAOYSA-N
SMILES:
CCn1nc(cc1C(=O)O)CC(C)C
Properties
Complexity:
206  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
196.121g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
196.25g/mol
Monoisotopic Mass:
196.121g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
55.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2  
Properties