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5-(bromomethyl)-1H-1,2,3,4-tetrazole

5-(bromomethyl)-1H-1,2,3,4-tetrazole

CAS: 167998-60-9

Formula: C2H3BrN4

SMILES: BrCC1=NN=NN1

IUPAC: 5-(bromomethyl)-1H-1,2,3,4-tetrazole

InChI: InChI=1S/C2H3BrN4/c3-1-2-4-6-7-5-2/h1H2,(H,4,5,6,7)

Composition: C (14.74%), H (1.86%), Br (49.03%), N (34.38%)

Molar Mass: 162.978

Atom Count: 10

Heavy Atom Count: 7

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 161.954109
Formal Charge 0
FSP3 0.5
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 1
InChIKey XLBVEAUNOAKOTB-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 30.5
Topological Polar Surface Area 54.46
Polarizability 10.4
Ring Count 1
Rotatable Bond Count 1

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96% <14 Days 167998-60-9 $680.40$680.40
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