AG001WN7

16632-21-6 | 2,4(1H,3H)-Pyrimidinedione, 6-methyl-5-nitro-

AG001WN7

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CAS Number	16632-21-6
Catalog Number	AG001WN7(AGN-PC-0JLVQX)
Chemical Name	2,4(1H,3H)-Pyrimidinedione, 6-methyl-5-nitro-
EC Number	240-688-1
IUPAC Name	6-methyl-5-nitro-1H-pyrimidine-2,4-dione
InChI	InChI=1S/C5H5N3O4/c1-2-3(8(11)12)4(9)7-5(10)6-2/h1H3,(H2,6,7,9,10)
InChI Key	LIVYMRJSNFHYEN-UHFFFAOYSA-N
MDL Number	MFCD00051201
Molecular Formula	C5H5N3O4
Molecular Weight	171.1109
NSC Number	40201
SMILES	CC1=C(C(NC(N1)=O)=O)[N+](=O)[O-]
Synonyms	5-Nitro-6-methyluracil, 16632-21-6, 6-Methyl-5-nitrouracil, 6-methyl-5-nitropyrimidine-2,4(1H,3H)-dione, 2,4-Dihydroxy-6-methyl-5-nitropyrimidine, 6-Metyl-5-nitrouracil, 6-methyl-5-nitropyrimidine-2,4-diol, 2,4(1H,3H)-Pyrimidinedione, 6-methyl-5-nitro-, 6-methyl-5-nitro-1H-pyrimidine-2,4-dione, Uracil, 6-methyl-5-nitro-, 4-Methyl-5-nitrouracil, 88890-66-8, LIVYMRJSNFHYEN-UHFFFAOYSA-N, 2,4-dihydroxy-6-methyl-5-*nitropyrimidine, 6-METHYL-5-NITROPYRIMIDINE-2,4-DIONE, t6mvmvj enw f1[wln], NSC40201, EINECS 240-688-1, zlchem 442, PubChem18704, PubChem23222, AC1Q2DJG, AC1Q2QFU, Maybridge1_006298, AC1L39NI, KSC494O4D, PYR396, SCHEMBL1674394, Jsp003347, CHEMBL3275229, CTK3J4741, HMS559G06, KS-00000DXZ, DTXSID80168091, ZLC0303, ACN-P000746, ZINC3898526, AC-651, ANW-50795, BBL025644, CN-128, MFCD00047362, MFCD00051201, NSC-40201, SBB069049, STK294123, STL377852, 5-nitro-6-methyl-2,4-pyrimidinediol, 6-methyl-5-nitro-2,4-pyrimidinediol, AKOS000416102, AKOS003621341, CS-W017662, MCULE-8271154753, RP23328, AJ-47387, AK-30273, AM803296, AN-15642, AS-11860, BC211174, BR-30273, EN002810, HC210360, SC-13823, SY003079, Pyrimidine, 2,4-diol-5-nitro-6-methyl-, AB0010890, AB0093339, AB1007156, DB-007095, ST2412120, 2,3H)-Pyrimidinedione, 6-methyl-5-nitro-, 4CH-012689, EU-0000846, FT-0600942, M2506, ST50409433, MFCD00051201 (98%), M-2797, Pyrimidine, 2,4-dihydroxy-5-nitro-6-methyl-, X-1973, 2,4-DIHYDROXY-5-NITRO-6-METHYLPYRIMIDINE, 6-Methyl-5-nitro-2,4(1H,3H)-pyrimidinedione #, 632N216, AC-907/30003030, SR-01000394711, 6-methyl-5-nitro-1,3-dihydropyrimidine-2,4-dione, S03-0115, SR-01000394711-1, W-107926, 2,4-Dihydroxy-6-methyl-5-nitropyrimidine, >=98.5%, 6-methyl-5-nitro-1,2,3,4-tetrahydropyrimidine-2,4-dione, C5H5N3O4, C5-H5-N3-O4, CID85523, AR-1L5815, ACN-027111, CS-T-19218, 5-Nitro-6-methyluracil, 98% - 1G 1g, 16950-75-7,

Complexity	300
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	171.028g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	171.112g/mol
Monoisotopic Mass	171.028g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	104A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	-0.6

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H332-H335
Packing Group
Precautionary statements	P280-P305+P351+P338-P310
Signal Words	warning
UN Code

Certificate of Analysis

Lot Number