AG000XPB

1280210-80-1 | Pyrrolo[3,4-c]pyrazole, 2,4,5,6-tetrahydro-2-(methylsulfonyl)-, benzenesulfonate (1:1)

AG000XPB

SDS

COA

Price

$0.00

Add to Cart

Buy Now

WARNING This product is not for human or veterinary use.

CAS Number	1280210-80-1
Catalog Number	AG000XPB(AGN-PC-0WCK4G)
Chemical Name	Pyrrolo[3,4-c]pyrazole, 2,4,5,6-tetrahydro-2-(methylsulfonyl)-, benzenesulfonate (1:1)
IUPAC Name	benzenesulfonic acid;2-methylsulfonyl-5,6-dihydro-4H-pyrrolo[3,4-c]pyrazole
InChI	InChI=1S/C6H9N3O2S.C6H6O3S/c1-12(10,11)9-4-5-2-7-3-6(5)8-9;7-10(8,9)6-4-2-1-3-5-6/h4,7H,2-3H2,1H3;1-5H,(H,7,8,9)
InChI Key	PKMDOTHXIGJTKH-UHFFFAOYSA-N
MDL Number	MFCD28144046
Molecular Formula	C12H15N3O5S2
Molecular Weight	345.3946
SMILES	O=S(N1N=C(CNC2)C2=C1)(C)=O.O=S(C3=CC=CC=C3)(O)=O
Synonyms	1280210-80-1, 2-(Methylsulfonyl)-2,4,5,6-tetrahydropyrrolo[3,4-c]pyrazole benzenesulfonate, MK-3102 interMediate3, 2-(methylsulfonyl)-2,4,5,6-tetrahydropyrrolo[3,4-c]pyrazol-5-ium benzenesulfonate, 2-(Methylsulfonyl)-2,4,5,6-tetrahydropyrrolo-[3,4-c]pyrazole benzenesulfonate, A1-00422, AMBZ0101, SCHEMBL9897082, PKMDOTHXIGJTKH-UHFFFAOYSA-N, BCP09769, CS-B1215, KS-00001F8S, MFCD28144046, AKOS025396353, ACN-037446, AM85543, SB17815, AC-28994, AK174061, AS-49754, SY237912, FT-0699758, MFCD28144046 (95%), 2,4,5,6-Tetrahydro-2-(methylsulfonyl)pyrrolo[3,4-c]pyrazole benzenesulfonate, 2-(Methylsulfonyl)-2,4,5,6-tetrahydropyrrolo[3,4-c]pyrazole benzenesulfonic acid salt, Pyrrolo[3,4-]yrazole, 2,4,5,6-etrahydro-2-(methylsulfonyl)-, benzenesulfonate, Pyrrolo[3,4-c]pyrazole, 2,4,5,6-tetrahydro-2-(methylsulfonyl)-, benzenesulfonate (1:1), Pyrrolo[3,4-c]pyrazole,2,4,5,6-tetrahydro-2-(methylsulfonyl)-,benzenesulfonate(1:1), 2-(methylsulfonyl)-2,4,5,6-tetrahydropyrrolo[3,4-c]pyrazole,

Complexity	455
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	2
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	345.045g/mol
Formal Charge	0
Heavy Atom Count	22
Hydrogen Bond Acceptor Count	7
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	345.388g/mol
Monoisotopic Mass	345.045g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	135A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H335
Packing Group
Precautionary statements	P280-P305+P351+P338
UN Code

Certificate of Analysis

Lot Number