Home Halogens Methyl 4-bromo-1-ethyl-3-methyl-1h-pyrazole-5-carboxylate

Methyl 4-bromo-1-ethyl-3-methyl-1h-pyrazole-5-carboxylate

CAS No.:
175276-98-9
Catalog Number:
AG0020RI
Molecular Formula:
C8H11BrN2O2
Molecular Weight:
247.0891
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
97%
In Stock USA
United States
$125
- +
1g
97%
In Stock USA
United States
$400
- +
Product Description
Catalog Number:
AG0020RI
Chemical Name:
Methyl 4-bromo-1-ethyl-3-methyl-1h-pyrazole-5-carboxylate
CAS Number:
175276-98-9
Molecular Formula:
C8H11BrN2O2
Molecular Weight:
247.0891
MDL Number:
MFCD00173775
IUPAC Name:
methyl 4-bromo-2-ethyl-5-methylpyrazole-3-carboxylate
InChI:
InChI=1S/C8H11BrN2O2/c1-4-11-7(8(12)13-3)6(9)5(2)10-11/h4H2,1-3H3
InChI Key:
RGVRHHCTCUKRLZ-UHFFFAOYSA-N
SMILES:
COC(=O)c1n(CC)nc(c1Br)C
Properties
Complexity:
201  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
246g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
247.092g/mol
Monoisotopic Mass:
246g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
44.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8  
Properties