Home Other Building Blocks 5-Bromo-1-(2,4-dimethoxybenzyl)tetrazole

5-Bromo-1-(2,4-dimethoxybenzyl)tetrazole

CAS No.:
1226321-67-0
Catalog Number:
AG00HGVG
Molecular Formula:
C10H11BrN4O2
Molecular Weight:
299.1239
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Product Description
Catalog Number:
AG00HGVG
Chemical Name:
5-Bromo-1-(2,4-dimethoxybenzyl)tetrazole
CAS Number:
1226321-67-0
Molecular Formula:
C10H11BrN4O2
Molecular Weight:
299.1239
MDL Number:
MFCD16458575
IUPAC Name:
5-bromo-1-[(2,4-dimethoxyphenyl)methyl]tetrazole
InChI:
InChI=1S/C10H11BrN4O2/c1-16-8-4-3-7(9(5-8)17-2)6-15-10(11)12-13-14-15/h3-5H,6H2,1-2H3
InChI Key:
DWPXDJPBGRLTHQ-UHFFFAOYSA-N
SMILES:
COc1cc(OC)ccc1Cn1nnnc1Br
Properties
Complexity:
246  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
298.007g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
299.128g/mol
Monoisotopic Mass:
298.007g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
62.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1  
Properties