Home Halogens 4-bromo-5-(chloromethyl)-1-methyl-1H-1,2,3-triazole

4-bromo-5-(chloromethyl)-1-methyl-1H-1,2,3-triazole

CAS No.:
1696888-62-6
Catalog Number:
AG01DYTZ
Molecular Formula:
C4H5BrClN3
Molecular Weight:
210.4596
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Product Description
Catalog Number:
AG01DYTZ
Chemical Name:
4-bromo-5-(chloromethyl)-1-methyl-1H-1,2,3-triazole
CAS Number:
1696888-62-6
Molecular Formula:
C4H5BrClN3
Molecular Weight:
210.4596
MDL Number:
MFCD29495475
IUPAC Name:
4-bromo-5-(chloromethyl)-1-methyltriazole
InChI:
InChI=1S/C4H5BrClN3/c1-9-3(2-6)4(5)7-8-9/h2H2,1H3
InChI Key:
YKXTZHHUKMHKLN-UHFFFAOYSA-N
SMILES:
ClCc1c(Br)nnn1C
Properties
Complexity:
102  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
208.936g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
210.459g/mol
Monoisotopic Mass:
208.936g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
30.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1  
Properties