Name: Name:3-methanesulfonyl-2,5-dimethylbenzene-1-sulfonyl chloride
Brand: Angene
SKU: AG01AB3C
Rating: 90 (10 reviews)

3-methanesulfonyl-2,5-dimethylbenzene-1-sulfonyl chloride

CAS No.:

1258639-68-7

Catalog Number:

AG01AB3C

Molecular Formula:

C9H11ClO4S2

Molecular Weight:

282.7642

Catalog Number:

AG01AB3C

Chemical Name:

3-methanesulfonyl-2,5-dimethylbenzene-1-sulfonyl chloride

CAS Number:

1258639-68-7

Molecular Formula:

C9H11ClO4S2

Molecular Weight:

282.7642

MDL Number:

MFCD17977050

IUPAC Name:

2,5-dimethyl-3-methylsulfonylbenzenesulfonyl chloride

InChI:

InChI=1S/C9H11ClO4S2/c1-6-4-8(15(3,11)12)7(2)9(5-6)16(10,13)14/h4-5H,1-3H3

InChI Key:

ZJOWCZXFVXWKDQ-UHFFFAOYSA-N

SMILES:

Cc1cc(c(c(c1)S(=O)(=O)Cl)C)S(=O)(=O)C

Complexity:

443

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

281.979g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

282.753g/mol

Monoisotopic Mass:

281.979g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

85A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.9