Name: Name:1-(2-Chloro-4-nitrophenyl)-1H-1,2,4-triazole
Brand: Angene
SKU: AG01DKB3
Rating: 90 (10 reviews)

1-(2-Chloro-4-nitrophenyl)-1H-1,2,4-triazole

CAS No.:

856452-73-8

Catalog Number:

AG01DKB3

Molecular Formula:

C8H5ClN4O2

Molecular Weight:

224.6039

Catalog Number:

AG01DKB3

Chemical Name:

1-(2-Chloro-4-nitrophenyl)-1H-1,2,4-triazole

CAS Number:

856452-73-8

Molecular Formula:

C8H5ClN4O2

Molecular Weight:

224.6039

MDL Number:

MFCD18622135

IUPAC Name:

1-(2-chloro-4-nitrophenyl)-1,2,4-triazole

InChI:

InChI=1S/C8H5ClN4O2/c9-7-3-6(13(14)15)1-2-8(7)12-5-10-4-11-12/h1-5H

InChI Key:

OLZCZHOPNAVSFO-UHFFFAOYSA-N

SMILES:

Clc1cc(ccc1n1cncn1)[N+](=O)[O-]

Complexity:

247

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

224.01g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

224.604g/mol

Monoisotopic Mass:

224.01g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

76.5A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.1