AG00FC1A

657410-79-2 | 1-Methyl-4-(6-nitropyridin-3-yl)piperazine

AG00FC1A

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CAS Number	657410-79-2
Catalog Number	AG00FC1A(AGN-PC-098W6O)
Chemical Name	1-Methyl-4-(6-nitropyridin-3-yl)piperazine
IUPAC Name	1-methyl-4-(6-nitropyridin-3-yl)piperazine
InChI	InChI=1S/C10H14N4O2/c1-12-4-6-13(7-5-12)9-2-3-10(11-8-9)14(15)16/h2-3,8H,4-7H2,1H3
InChI Key	YVQVMPXTKXNMIV-UHFFFAOYSA-N
MDL Number	MFCD11520856
Molecular Formula	C10H14N4O2
Molecular Weight	222.2438
SMILES	O=[N+](C1=CC=C(N2CCN(C)CC2)C=N1)[O-]
Synonyms	1-METHYL-4-(6-NITROPYRIDIN-3-YL)PIPERAZINE, 657410-79-2, 1-Methyl-4-(6-nitro-pyridin-3-yl)-piperazine, Piperazine, 1-methyl-4-(6-nitro-3-pyridinyl)-, SCHEMBL521907, SCHEMBL13139587, CTK8J8895, DTXSID50680199, YVQVMPXTKXNMIV-UHFFFAOYSA-N, CS-M3135, KS-00001A6G, MFCD11520856, ZINC36108812, AKOS016013159, MCULE-2001225308, RL04509, AJ-92399, AM804201, DS-10842, 1-methyl-4-(6-nitro-3-pyridyl)piperazine, DB-073657, FT-0701479, Methyl-4-(6-nitro-pyridin-3-yl)-piperazine, Y6344, L-2120, J-504942, 1-METHYL-4- PIPERAZINE, C10H14N4O2,

Complexity	248
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	222.112g/mol
Formal Charge	0
Heavy Atom Count	16
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	222.248g/mol
Monoisotopic Mass	222.112g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	65.2A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.9

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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