Name: Name:Butanoic acid,4-[[(2,3-dihydro-1,4-benzodioxin-6-yl)sulfonyl]amino]-
Brand: Angene
SKU: AG007JU0
Rating: 90 (10 reviews)

Butanoic acid,4-[[(2,3-dihydro-1,4-benzodioxin-6-yl)sulfonyl]amino]-

CAS No.:

300571-94-2

Catalog Number:

AG007JU0

Molecular Formula:

C12H15NO6S

Molecular Weight:

301.3156

Catalog Number:

AG007JU0

Chemical Name:

Butanoic acid,4-[[(2,3-dihydro-1,4-benzodioxin-6-yl)sulfonyl]amino]-

CAS Number:

300571-94-2

Molecular Formula:

C12H15NO6S

Molecular Weight:

301.3156

MDL Number:

MFCD01124441

IUPAC Name:

4-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylamino)butanoic acid

InChI:

InChI=1S/C12H15NO6S/c14-12(15)2-1-5-13-20(16,17)9-3-4-10-11(8-9)19-7-6-18-10/h3-4,8,13H,1-2,5-7H2,(H,14,15)

InChI Key:

DGXXDRKDKYCRLS-UHFFFAOYSA-N

SMILES:

OC(=O)CCCNS(=O)(=O)c1ccc2c(c1)OCCO2

Complexity:

432

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

301.062g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

301.313g/mol

Monoisotopic Mass:

301.062g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

110A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

0.5