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

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

CAS: 3441-00-7

Formula: C8H8N4

SMILES: CC1=CC=CC(=C1)C1=NNN=N1

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

InChI: InChI=1S/C8H8N4/c1-6-3-2-4-7(5-6)8-9-11-12-10-8/h2-5H,1H3,(H,9,10,11,12)

Composition: C (59.99%), H (5.03%), N (34.98%)

Molar Mass: 160.18

Atom Count: 20

Heavy Atom Count: 12

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	160.074896274
Formal Charge	0
FSP3	0.12
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
InChIKey	GWZNHKMUSLKULV-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	58.46
Topological Polar Surface Area	54.46
Polarizability	17.42
Ring Count	2
Rotatable Bond Count	1

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