Name: Name:1-[4-(propan-2-yl)phenyl]-1H-1,2,3,4-tetrazole-5-thiol
Brand: Angene
SKU: AG019O40
Rating: 90 (10 reviews)

1-[4-(propan-2-yl)phenyl]-1H-1,2,3,4-tetrazole-5-thiol

CAS No.:

121690-13-9

Catalog Number:

AG019O40

Molecular Formula:

C10H12N4S

Molecular Weight:

220.2941

Catalog Number:

AG019O40

Chemical Name:

1-[4-(propan-2-yl)phenyl]-1H-1,2,3,4-tetrazole-5-thiol

CAS Number:

121690-13-9

Molecular Formula:

C10H12N4S

Molecular Weight:

220.2941

MDL Number:

MFCD06655442

IUPAC Name:

1-(4-propan-2-ylphenyl)-2H-tetrazole-5-thione

InChI:

InChI=1S/C10H12N4S/c1-7(2)8-3-5-9(6-4-8)14-10(15)11-12-13-14/h3-7H,1-2H3,(H,11,13,15)

InChI Key:

GLESZQGPJXOSSI-UHFFFAOYSA-N

SMILES:

CC(c1ccc(cc1)n1nnnc1S)C

Complexity:

269

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

220.078g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

220.294g/mol

Monoisotopic Mass:

220.078g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

72.1A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

3.9