4-methyl-1H-1,2,3-benzotriazole

4-methyl-1H-1,2,3-benzotriazole

CAS: 29878-31-7

Formula: C7H7N3

SMILES: CC1=C2N=NNC2=CC=C1

IUPAC: 4-methyl-1H-1,2,3-benzotriazole

InChI: InChI=1S/C7H7N3/c1-5-3-2-4-6-7(5)9-10-8-6/h2-4H,1H3,(H,8,9,10)

Composition: C (63.14%), H (5.30%), N (31.56%)

Molar Mass: 133.154

Atom Count: 17

Heavy Atom Count: 10

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	133.063997237
Formal Charge	0
FSP3	0.14
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
InChIKey	CMGDVUCDZOBDNL-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	39.1
Topological Polar Surface Area	41.57
Polarizability	15.55
Ring Count	2
Rotatable Bond Count	0

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