Name: Name:1-(4-methanesulfonyl-3-methoxyphenyl)ethan-1-one
Brand: Angene
SKU: AG01A7Z1
Rating: 90 (10 reviews)

1-(4-methanesulfonyl-3-methoxyphenyl)ethan-1-one

CAS No.:

1221723-67-6

Catalog Number:

AG01A7Z1

Molecular Formula:

C10H12O4S

Molecular Weight:

228.2649

Catalog Number:

AG01A7Z1

Chemical Name:

1-(4-methanesulfonyl-3-methoxyphenyl)ethan-1-one

CAS Number:

1221723-67-6

Molecular Formula:

C10H12O4S

Molecular Weight:

228.2649

MDL Number:

MFCD14705879

IUPAC Name:

1-(3-methoxy-4-methylsulfonylphenyl)ethanone

InChI:

InChI=1S/C10H12O4S/c1-7(11)8-4-5-10(15(3,12)13)9(6-8)14-2/h4-6H,1-3H3

InChI Key:

XVNJSSYPLKKJPE-UHFFFAOYSA-N

SMILES:

COc1cc(ccc1S(=O)(=O)C)C(=O)C

Complexity:

328

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

228.046g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

228.262g/mol

Monoisotopic Mass:

228.046g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

68.8A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

0.8