Name: Name:5-(acetamidomethyl)-1-methyl-1H-pyrazole-4-sulfonyl chloride
Brand: Angene
SKU: AG01DVXE
Rating: 90 (10 reviews)

5-(acetamidomethyl)-1-methyl-1H-pyrazole-4-sulfonyl chloride

CAS No.:

1365939-89-4

Catalog Number:

AG01DVXE

Molecular Formula:

C7H10ClN3O3S

Molecular Weight:

251.6906

Catalog Number:

AG01DVXE

Chemical Name:

5-(acetamidomethyl)-1-methyl-1H-pyrazole-4-sulfonyl chloride

CAS Number:

1365939-89-4

Molecular Formula:

C7H10ClN3O3S

Molecular Weight:

251.6906

MDL Number:

MFCD21601448

IUPAC Name:

5-(acetamidomethyl)-1-methylpyrazole-4-sulfonyl chloride

InChI:

InChI=1S/C7H10ClN3O3S/c1-5(12)9-3-6-7(15(8,13)14)4-10-11(6)2/h4H,3H2,1-2H3,(H,9,12)

InChI Key:

BMKJWRAWGDQGGV-UHFFFAOYSA-N

SMILES:

CC(=O)NCc1n(C)ncc1S(=O)(=O)Cl

Complexity:

340

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

251.013g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

251.685g/mol

Monoisotopic Mass:

251.013g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

89.4A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

-0.6