Name: Name:6-methoxy-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonyl chloride
Brand: Angene
SKU: AG01BE9A
Rating: 90 (10 reviews)

6-methoxy-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonyl chloride

CAS No.:

1368585-15-2

Catalog Number:

AG01BE9A

Molecular Formula:

C9H8ClNO5S

Molecular Weight:

277.6815

Catalog Number:

AG01BE9A

Chemical Name:

6-methoxy-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonyl chloride

CAS Number:

1368585-15-2

Molecular Formula:

C9H8ClNO5S

Molecular Weight:

277.6815

MDL Number:

MFCD21908305

IUPAC Name:

6-methoxy-3-oxo-4H-1,4-benzoxazine-7-sulfonyl chloride

InChI:

InChI=1S/C9H8ClNO5S/c1-15-7-2-5-6(16-4-9(12)11-5)3-8(7)17(10,13)14/h2-3H,4H2,1H3,(H,11,12)

InChI Key:

NYFGIVUWJJZFHA-UHFFFAOYSA-N

SMILES:

COc1cc2NC(=O)COc2cc1S(=O)(=O)Cl

Complexity:

406

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

276.981g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

277.675g/mol

Monoisotopic Mass:

276.981g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

90.1A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

0.9