Name: Name:2-(1H-1,3-benzodiazol-2-yl)-2-methanesulfonylacetaldehyde
Brand: Angene
SKU: AG019K33
Rating: 90 (10 reviews)

2-(1H-1,3-benzodiazol-2-yl)-2-methanesulfonylacetaldehyde

CAS No.:

923794-30-3

Catalog Number:

AG019K33

Molecular Formula:

C10H10N2O3S

Molecular Weight:

238.2630

Catalog Number:

AG019K33

Chemical Name:

2-(1H-1,3-benzodiazol-2-yl)-2-methanesulfonylacetaldehyde

CAS Number:

923794-30-3

Molecular Formula:

C10H10N2O3S

Molecular Weight:

238.2630

MDL Number:

MFCD08444339

IUPAC Name:

2-(1H-benzimidazol-2-yl)-2-methylsulfonylacetaldehyde

InChI:

InChI=1S/C10H10N2O3S/c1-16(14,15)9(6-13)10-11-7-4-2-3-5-8(7)12-10/h2-6,9H,1H3,(H,11,12)

InChI Key:

CDMDPRCFRUTREL-UHFFFAOYSA-N

SMILES:

O=CC(S(=O)(=O)C)c1nc2c([nH]1)cccc2

Complexity:

363

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

238.041g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

238.261g/mol

Monoisotopic Mass:

238.041g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

88.3A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

0.4