AG00C5D4

3920-38-5 | 1,3-Dimethyl-4-nitro-1H-pyrazole

AG00C5D4

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CAS Number	3920-38-5
Catalog Number	AG00C5D4(AGN-PC-0JV5YO)
Chemical Name	1,3-Dimethyl-4-nitro-1H-pyrazole
IUPAC Name	1,3-dimethyl-4-nitropyrazole
InChI	InChI=1S/C5H7N3O2/c1-4-5(8(9)10)3-7(2)6-4/h3H,1-2H3
InChI Key	AKFKERAVXIGUNB-UHFFFAOYSA-N
MDL Number	MFCD00464263
Molecular Formula	C5H7N3O2
Molecular Weight	141.1280
SMILES	O=[N+](C1=CN(C)N=C1C)[O-]
Synonyms	1,3-Dimethyl-4-nitro-1H-pyrazole, 3920-38-5, 1,3-dimethyl-4-nitropyrazole, 1H-PYRAZOLE, 1,3-DIMETHYL-4-NITRO-, ZERO/003106, AC1LDX9L, SCHEMBL2760410, CTK6I3463, KS-00000DRO, ZINC85312, DTXSID20351541, AKFKERAVXIGUNB-UHFFFAOYSA-N, ALBB-012562, 5115AB, MFCD00464263, SBB002083, STK299955, AKOS000271443, AKOS015922225, AB06197, CS-W006658, DS-6919, MCULE-2913890567, AJ-10708, AK123270, CJ-00694, SC-83205, SY040027, ST4055454, TX-015842, 4CH-009471, BB 0259586, ST24026763, MFCD00464263 (95%), C5H7N3O2, CID702892,

Complexity	144
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	141.054g/mol
Formal Charge	0
Heavy Atom Count	10
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	141.13g/mol
Monoisotopic Mass	141.054g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	63.6A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.5

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

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