Name: Name:1,2,4-Thiadiazole, 5-chloro-3-(4-nitrophenyl)-
Brand: Angene
SKU: AG008BUD
Rating: 90 (10 reviews)

1,2,4-Thiadiazole, 5-chloro-3-(4-nitrophenyl)-

CAS No.:

88541-07-5

Catalog Number:

AG008BUD

Molecular Formula:

C8H4ClN3O2S

Molecular Weight:

241.6543

Catalog Number:

AG008BUD

Chemical Name:

1,2,4-Thiadiazole, 5-chloro-3-(4-nitrophenyl)-

CAS Number:

88541-07-5

Molecular Formula:

C8H4ClN3O2S

Molecular Weight:

241.6543

MDL Number:

MFCD14707346

IUPAC Name:

5-chloro-3-(4-nitrophenyl)-1,2,4-thiadiazole

InChI:

InChI=1S/C8H4ClN3O2S/c9-8-10-7(11-15-8)5-1-3-6(4-2-5)12(13)14/h1-4H

InChI Key:

GULLVHSUPXBMAI-UHFFFAOYSA-N

SMILES:

Clc1snc(n1)c1ccc(cc1)[N+](=O)[O-]

Complexity:

243

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

240.971g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

241.649g/mol

Monoisotopic Mass:

240.971g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

99.8A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.4