AG00C5OS

38858-89-8 | 3,5-Dinitro-1H-pyrazole

AG00C5OS

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CAS Number	38858-89-8
Catalog Number	AG00C5OS(AGN-PC-0JMSJW)
Chemical Name	3,5-Dinitro-1H-pyrazole
IUPAC Name	3,5-dinitro-1H-pyrazole
InChI	InChI=1S/C3H2N4O4/c8-6(9)2-1-3(5-4-2)7(10)11/h1H,(H,4,5)
InChI Key	UKZXCZWGGXVKNN-UHFFFAOYSA-N
MDL Number	MFCD06618360
Molecular Formula	C3H2N4O4
Molecular Weight	158.0724
SMILES	O=[N+](C1=CC([N+]([O-])=O)=NN1)[O-]
Synonyms	3,5-dinitro-1H-pyrazole, 38858-89-8, 3,5-Dinitropyrazole, UKZXCZWGGXVKNN-UHFFFAOYSA-N, dinitropyrazole, ZERO/005625, AC1L3KW0, SCHEMBL162091, 1H-Pyrazole, 3,5-dinitro-, CTK1C5512, DTXSID30192109, ACN-S001946, ALBB-008658, ZINC4343199, MFCD06618360, SBB013537, STK505478, AKOS005168955, AKOS015922430, AKOS025394669, ACN-001946, MCULE-2835915782, AS-47168, ST084595, TR-015634, BB 0260073, FT-0679402, R9205, I14-25718, CID142323,

Complexity	183
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	158.008g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	158.073g/mol
Monoisotopic Mass	158.008g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	120A^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-H320-H335
Packing Group
Precautionary statements	P261-P280-P301+P312-P302+P352-P305+P351+P338
UN Code

Certificate of Analysis

Lot Number