Home Halogens Ethyl 3-bromo-1H-pyrazole-5-carboxylate

Ethyl 3-bromo-1H-pyrazole-5-carboxylate

CAS No.:
1886994-07-5
Catalog Number:
AG002H5J
Molecular Formula:
C6H7BrN2O2
Molecular Weight:
219.0360
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
95%
In Stock USA
United States
$188
- +
1g
95%
In Stock USA
United States
$407
- +
5g
95%
In Stock USA
United States
$1225
- +
10g
95%
In Stock USA
United States
$2113
- +
Product Description
Catalog Number:
AG002H5J
Chemical Name:
Ethyl 3-bromo-1H-pyrazole-5-carboxylate
CAS Number:
1886994-07-5
Molecular Formula:
C6H7BrN2O2
Molecular Weight:
219.0360
MDL Number:
MFCD28393486
IUPAC Name:
ethyl 5-bromo-1H-pyrazole-3-carboxylate
InChI:
InChI=1S/C6H7BrN2O2/c1-2-11-6(10)4-3-5(7)9-8-4/h3H,2H2,1H3,(H,8,9)
InChI Key:
WTWIBLHEPZYWRK-UHFFFAOYSA-N
SMILES:
CCOC(=O)c1cc(n[nH]1)Br
Properties
Complexity:
154  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
217.969g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
219.038g/mol
Monoisotopic Mass:
217.969g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
55A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8  
Properties