Name: Name:5-chloro-2-[(1-methyl-1H-1,2,3,4-tetrazol-5-yl)sulfanyl]aniline
Brand: Angene
SKU: AG01A87V
Rating: 90 (10 reviews)

5-chloro-2-[(1-methyl-1H-1,2,3,4-tetrazol-5-yl)sulfanyl]aniline

CAS No.:

1019390-35-2

Catalog Number:

AG01A87V

Molecular Formula:

C8H8ClN5S

Molecular Weight:

241.7006

Catalog Number:

AG01A87V

Chemical Name:

5-chloro-2-[(1-methyl-1H-1,2,3,4-tetrazol-5-yl)sulfanyl]aniline

CAS Number:

1019390-35-2

Molecular Formula:

C8H8ClN5S

Molecular Weight:

241.7006

MDL Number:

MFCD11132293

IUPAC Name:

5-chloro-2-(1-methyltetrazol-5-yl)sulfanylaniline

InChI:

InChI=1S/C8H8ClN5S/c1-14-8(11-12-13-14)15-7-3-2-5(9)4-6(7)10/h2-4H,10H2,1H3

InChI Key:

MIYSDESIDYVDQL-UHFFFAOYSA-N

SMILES:

Clc1ccc(c(c1)N)Sc1nnnn1C

Complexity:

219

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

241.019g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

241.697g/mol

Monoisotopic Mass:

241.019g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

94.9A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.9