Home Halogens 4-(bromomethyl)-1-tert-butyl-1H-1,2,3-triazole

4-(bromomethyl)-1-tert-butyl-1H-1,2,3-triazole

CAS No.:
942060-17-5
Catalog Number:
AG01B4Y3
Molecular Formula:
C7H12BrN3
Molecular Weight:
218.0943
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Product Description
Catalog Number:
AG01B4Y3
Chemical Name:
4-(bromomethyl)-1-tert-butyl-1H-1,2,3-triazole
CAS Number:
942060-17-5
Molecular Formula:
C7H12BrN3
Molecular Weight:
218.0943
MDL Number:
MFCD24460868
IUPAC Name:
4-(bromomethyl)-1-tert-butyltriazole
InChI:
InChI=1S/C7H12BrN3/c1-7(2,3)11-5-6(4-8)9-10-11/h5H,4H2,1-3H3
InChI Key:
FVWFYCHAJGZUFJ-UHFFFAOYSA-N
SMILES:
BrCc1nnn(c1)C(C)(C)C
Properties
Complexity:
132  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
217.021g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
218.098g/mol
Monoisotopic Mass:
217.021g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
30.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2  
Properties