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Home > Bromides > 1354777-43-7
1354777-43-7 | 5-bromo-7-methyl-1H-1,2,3-benzotriazole
CAS No: 1354777-43-7 Catalog No: AG01EL5M MDL No:MFCD22561383
Product Description
Catalog Number:
AG01EL5M
Chemical Name:
5-bromo-7-methyl-1H-1,2,3-benzotriazole
CAS Number:
1354777-43-7
Molecular Formula:
C7H6BrN3
Molecular Weight:
212.0466
MDL Number:
MFCD22561383
IUPAC Name:
6-bromo-4-methyl-2H-benzotriazole
InChI:
InChI=1S/C7H6BrN3/c1-4-2-5(8)3-6-7(4)10-11-9-6/h2-3H,1H3,(H,9,10,11)
InChI Key:
AWZVOWGMSCDYMP-UHFFFAOYSA-N
SMILES:
Brc1cc(C)c2c(c1)nn[nH]2
Properties
Complexity:
153
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
210.975g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
212.05g/mol
Monoisotopic Mass:
210.975g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
41.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
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