AG0028GT

202842-98-6 | 1H-Pyrazole, 3,4-dimethyl-, phosphate (1:1)

AG0028GT

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CAS Number	202842-98-6
Catalog Number	AG0028GT(AGN-PC-0O78O4)
Chemical Name	1H-Pyrazole, 3,4-dimethyl-, phosphate (1:1)
EC Number	424-640-9
IUPAC Name	4,5-dimethyl-1H-pyrazole;phosphoric acid
InChI	InChI=1S/C5H8N2.H3O4P/c1-4-3-6-7-5(4)2;1-5(2,3)4/h3H,1-2H3,(H,6,7);(H3,1,2,3,4)
InChI Key	LXKCHCXZBPLTAE-UHFFFAOYSA-N
MDL Number	MFCD09842544
Molecular Formula	C5H11N2O4P
Molecular Weight	194.1256
SMILES	P(=O)(O)(O)O.CC1=NNC=C1C
Synonyms	3,4-dimethylpyrazole phosphate, 3,4-DMPP, 3,4-Dimethyl-1H-pyrazole phosphate, 202842-98-6, 3,4-Dimethylpyrazole Phosphate, 1H-Pyrazole, 3,4-dimethyl-, phosphate (1:1), 3,4-Dimethyl-1H-pyrazolium dihydrogen phosphate, AK111434, SCHEMBL225213, C5H11N2O4P, SCHEMBL20641402, CTK0J9130, DTXSID30466110, BCP21998, KS-000002IQ, MFCD09842544, AKOS016009372, 4,5-dimethyl-1H-pyrazole,phosphoric acid, AS-19974, AX8170873, CS-0028725, FT-0667545, ST24028191, Z2664, J-013177, DMPP, CID11446863, IUPAC: 3,4-dimethyl-2H-pyrazole; Phosphoric Acid,

Complexity	113
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	2
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	194.046g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	4
Isotope Atom Count	0
Molecular Weight	194.127g/mol
Monoisotopic Mass	194.046g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	106A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H332-H335
Packing Group
Precautionary statements	P261-P280-P305+P351+P338
UN Code

Certificate of Analysis

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