Home Halogens Methyl 4-chloro-1H-pyrazole-3-carboxylate

Methyl 4-chloro-1H-pyrazole-3-carboxylate

CAS No.:
1005584-90-6
Catalog Number:
AG0002BG
Molecular Formula:
C5H5ClN2O2
Molecular Weight:
160.5584
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$62
- +
5g
98%
In Stock USA
United States
$200
- +
10g
98%
In Stock USA
United States
$331
- +
25g
98%
In Stock USA
United States
$694
- +
100g
98%
In Stock USA
United States
$2350
- +
Product Description
Catalog Number:
AG0002BG
Chemical Name:
Methyl 4-chloro-1H-pyrazole-3-carboxylate
CAS Number:
1005584-90-6
Molecular Formula:
C5H5ClN2O2
Molecular Weight:
160.5584
MDL Number:
MFCD04969136
IUPAC Name:
methyl 4-chloro-1H-pyrazole-5-carboxylate
InChI:
InChI=1S/C5H5ClN2O2/c1-10-5(9)4-3(6)2-7-8-4/h2H,1H3,(H,7,8)
InChI Key:
AQUQWWCPNUDMIX-UHFFFAOYSA-N
SMILES:
COC(=O)c1n[nH]cc1Cl
Properties
Complexity:
142  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
160.004g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
160.557g/mol
Monoisotopic Mass:
160.004g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
55A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1  
Properties