Name: Name:3-methyl-2-oxo-3,4-dihydro-2H-1,3-benzoxazine-6-sulfonyl chloride
Brand: Angene
SKU: AG01A3OR
Rating: 90 (10 reviews)

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

CAS No.:

1383579-87-0

Catalog Number:

AG01A3OR

Molecular Formula:

C9H8ClNO4S

Molecular Weight:

261.6821

Catalog Number:

AG01A3OR

Chemical Name:

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

CAS Number:

1383579-87-0

Molecular Formula:

C9H8ClNO4S

Molecular Weight:

261.6821

MDL Number:

MFCD23144043

IUPAC Name:

3-methyl-2-oxo-4H-1,3-benzoxazine-6-sulfonyl chloride

InChI:

InChI=1S/C9H8ClNO4S/c1-11-5-6-4-7(16(10,13)14)2-3-8(6)15-9(11)12/h2-4H,5H2,1H3

InChI Key:

KWWOYMZGHAYEAJ-UHFFFAOYSA-N

SMILES:

O=C1Oc2ccc(cc2CN1C)S(=O)(=O)Cl

Complexity:

391

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

260.986g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

261.676g/mol

Monoisotopic Mass:

260.986g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

72.1A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.3