Name: Name:7-(chlorosulphonyl)-2,3-dihydro-1,4-benzodioxin-5-carboxylic acid
Brand: Angene
SKU: AG00FM3G
Rating: 90 (10 reviews)

7-(chlorosulphonyl)-2,3-dihydro-1,4-benzodioxin-5-carboxylic acid

CAS No.:

66410-36-4

Catalog Number:

AG00FM3G

Molecular Formula:

C9H7ClO6S

Molecular Weight:

278.6663

Catalog Number:

AG00FM3G

Chemical Name:

7-(chlorosulphonyl)-2,3-dihydro-1,4-benzodioxin-5-carboxylic acid

CAS Number:

66410-36-4

Molecular Formula:

C9H7ClO6S

Molecular Weight:

278.6663

MDL Number:

MFCD09042610

IUPAC Name:

7-chlorosulfonyl-2,3-dihydro-1,4-benzodioxine-5-carboxylic acid

InChI:

InChI=1S/C9H7ClO6S/c10-17(13,14)5-3-6(9(11)12)8-7(4-5)15-1-2-16-8/h3-4H,1-2H2,(H,11,12)

InChI Key:

NCSFGFOXYGSSSH-UHFFFAOYSA-N

SMILES:

OC(=O)c1cc(cc2c1OCCO2)S(=O)(=O)Cl

EC Number:

266-345-6

Complexity:

402

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

277.965g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

278.659g/mol

Monoisotopic Mass:

277.965g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

98.3A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.2