2-methoxy-4-(2H-1,2,3,4-tetrazol-5-yl)phenol

2-methoxy-4-(2H-1,2,3,4-tetrazol-5-yl)phenol

CAS: 376609-66-4

Formula: C8H8N4O2

SMILES: COC1=CC(=CC=C1O)C1=NNN=N1

IUPAC: 2-methoxy-4-(2H-1,2,3,4-tetrazol-5-yl)phenol

InChI: InChI=1S/C8H8N4O2/c1-14-7-4-5(2-3-6(7)13)8-9-11-12-10-8/h2-4,13H,1H3,(H,9,10,11,12)

Composition: C (50.00%), H (4.20%), N (29.15%), O (16.65%)

Molar Mass: 192.178

Atom Count: 22

Heavy Atom Count: 14

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	192.064725514
Formal Charge	0
FSP3	0.12
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	2
InChIKey	ODAXBFZKBKYTGD-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	61.86
Topological Polar Surface Area	83.92
Polarizability	18.82
Ring Count	2
Rotatable Bond Count	2

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