Name: Name:1-benzyl-3,5-dimethyl-1H-pyrazole-4-sulfonyl chloride
Brand: Angene
SKU: AG01APKI
Rating: 90 (10 reviews)

1-benzyl-3,5-dimethyl-1H-pyrazole-4-sulfonyl chloride

CAS No.:

1156916-20-9

Catalog Number:

AG01APKI

Molecular Formula:

C12H13ClN2O2S

Molecular Weight:

284.7618

Catalog Number:

AG01APKI

Chemical Name:

1-benzyl-3,5-dimethyl-1H-pyrazole-4-sulfonyl chloride

CAS Number:

1156916-20-9

Molecular Formula:

C12H13ClN2O2S

Molecular Weight:

284.7618

MDL Number:

MFCD12192694

IUPAC Name:

1-benzyl-3,5-dimethylpyrazole-4-sulfonyl chloride

InChI:

InChI=1S/C12H13ClN2O2S/c1-9-12(18(13,16)17)10(2)15(14-9)8-11-6-4-3-5-7-11/h3-7H,8H2,1-2H3

InChI Key:

RAPGSKRVLRMHSN-UHFFFAOYSA-N

SMILES:

Cc1nn(c(c1S(=O)(=O)Cl)C)Cc1ccccc1

Complexity:

376

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

284.039g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

284.758g/mol

Monoisotopic Mass:

284.039g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

60.3A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.7