Home Halogens 5-(chloromethyl)-1-(2-fluoroethyl)-1H-1,2,4-triazole hydrochloride

5-(chloromethyl)-1-(2-fluoroethyl)-1H-1,2,4-triazole hydrochloride

CAS No.:
1803592-97-3
Catalog Number:
AG01B8E1
Molecular Formula:
C5H8Cl2FN3
Molecular Weight:
200.0415
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Product Description
Catalog Number:
AG01B8E1
Chemical Name:
5-(chloromethyl)-1-(2-fluoroethyl)-1H-1,2,4-triazole hydrochloride
CAS Number:
1803592-97-3
Molecular Formula:
C5H8Cl2FN3
Molecular Weight:
200.0415
MDL Number:
MFCD28246482
IUPAC Name:
5-(chloromethyl)-1-(2-fluoroethyl)-1,2,4-triazole;hydrochloride
InChI:
InChI=1S/C5H7ClFN3.ClH/c6-3-5-8-4-9-10(5)2-1-7;/h4H,1-3H2;1H
InChI Key:
JLEQRCFXMUOKFM-UHFFFAOYSA-N
SMILES:
FCCn1ncnc1CCl.Cl
Properties
Complexity:
103  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
199.008g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
200.038g/mol
Monoisotopic Mass:
199.008g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
30.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties