Home Halogens 4-(chloromethyl)-1-(2-fluoroethyl)-1H-pyrazole hydrochloride

4-(chloromethyl)-1-(2-fluoroethyl)-1H-pyrazole hydrochloride

CAS No.:
1855907-54-8
Catalog Number:
AG01ELR3
Molecular Formula:
C6H9Cl2FN2
Molecular Weight:
199.0535
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Product Description
Catalog Number:
AG01ELR3
Chemical Name:
4-(chloromethyl)-1-(2-fluoroethyl)-1H-pyrazole hydrochloride
CAS Number:
1855907-54-8
Molecular Formula:
C6H9Cl2FN2
Molecular Weight:
199.0535
MDL Number:
MFCD31380940
IUPAC Name:
4-(chloromethyl)-1-(2-fluoroethyl)pyrazole;hydrochloride
InChI:
InChI=1S/C6H8ClFN2.ClH/c7-3-6-4-9-10(5-6)2-1-8;/h4-5H,1-3H2;1H
InChI Key:
LYCJGZZIWXRPMG-UHFFFAOYSA-N
SMILES:
FCCn1ncc(c1)CCl.Cl
Properties
Complexity:
102  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
198.013g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
199.05g/mol
Monoisotopic Mass:
198.013g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
17.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties