Name: Name:2-[4-(propane-2-sulfonyl)phenyl]acetic acid
Brand: Angene
SKU: AG01AHQM
Rating: 90 (10 reviews)

2-[4-(propane-2-sulfonyl)phenyl]acetic acid

CAS No.:

1105193-73-4

Catalog Number:

AG01AHQM

Molecular Formula:

C11H14O4S

Molecular Weight:

242.2915

Catalog Number:

AG01AHQM

Chemical Name:

2-[4-(propane-2-sulfonyl)phenyl]acetic acid

CAS Number:

1105193-73-4

Molecular Formula:

C11H14O4S

Molecular Weight:

242.2915

MDL Number:

MFCD11986718

IUPAC Name:

2-(4-propan-2-ylsulfonylphenyl)acetic acid

InChI:

InChI=1S/C11H14O4S/c1-8(2)16(14,15)10-5-3-9(4-6-10)7-11(12)13/h3-6,8H,7H2,1-2H3,(H,12,13)

InChI Key:

DNYIDVSDKGJLEJ-UHFFFAOYSA-N

SMILES:

OC(=O)Cc1ccc(cc1)S(=O)(=O)C(C)C

Complexity:

332

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

242.061g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

242.289g/mol

Monoisotopic Mass:

242.061g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

79.8A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.1