Name: Name:Benzenesulfonamide, 4-chloro-N,N-dimethyl-3-nitro-
Brand: Angene
SKU: AG0012O7
Rating: 90 (10 reviews)

Benzenesulfonamide, 4-chloro-N,N-dimethyl-3-nitro-

CAS No.:

137-47-3

Catalog Number:

AG0012O7

Molecular Formula:

C8H9ClN2O4S

Molecular Weight:

264.6861

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Product Description

Catalog Number:

AG0012O7

Chemical Name:

Benzenesulfonamide, 4-chloro-N,N-dimethyl-3-nitro-

CAS Number:

137-47-3

Molecular Formula:

C8H9ClN2O4S

Molecular Weight:

264.6861

MDL Number:

MFCD00088651

IUPAC Name:

4-chloro-N,N-dimethyl-3-nitrobenzenesulfonamide

InChI:

InChI=1S/C8H9ClN2O4S/c1-10(2)16(14,15)6-3-4-7(9)8(5-6)11(12)13/h3-5H,1-2H3

InChI Key:

HBTAOSGHCXUEKI-UHFFFAOYSA-N

SMILES:

[O-][N+](=O)c1cc(ccc1Cl)S(=O)(=O)N(C)C

EC Number:

205-295-1

NSC Number:

231629

Properties

Complexity:

359

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

263.997g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

264.68g/mol

Monoisotopic Mass:

263.997g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

91.6A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.4

Literature

Title	Journal
Nitrobenzene compounds inhibit expression of VCAM-1.	Bioorganic & medicinal chemistry letters 20010723

Properties