AG003LUY

104-04-1 | N-(4-Nitrophenyl)acetamide

AG003LUY

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CAS Number	104-04-1
Catalog Number	AG003LUY(AGN-PC-0JK87L)
Chemical Name	N-(4-Nitrophenyl)acetamide
EC Number	203-169-0
IUPAC Name	N-(4-nitrophenyl)acetamide
InChI	InChI=1S/C8H8N2O3/c1-6(11)9-7-2-4-8(5-3-7)10(12)13/h2-5H,1H3,(H,9,11)
InChI Key	NQRLPDFELNCFHW-UHFFFAOYSA-N
MDL Number	MFCD00007303
Molecular Formula	C8H8N2O3
Molecular Weight	180.1607
NSC Number	1315
SMILES	CC(NC1=CC=C([N+]([O-])=O)C=C1)=O
UNII	PH3B066365
Synonyms	4-nitroacetanilide, 4'-Nitroacetanilide, N-(4-Nitrophenyl)acetamide, 104-04-1, 4-NITROACETANILIDE, P-Nitroacetanilide, Acetamide, N-(4-nitrophenyl)-, N-Acetyl-4-nitroaniline, p-Acetamidonitrobenzene, Acetanilide, p-nitro-, p-Nitrophenylacetanilide, N-Acetyl-p-nitroaniline, Acetanilide, 4'-nitro-, NSC 1315, CCRIS 5566, UNII-PH3B066365, EINECS 203-169-0, Acetic acid 4-nitroanilide, AI3-01545, NQRLPDFELNCFHW-UHFFFAOYSA-N, MFCD00007303, PH3B066365, 4'-Nitroacetanilide, 99%, Acetamide, N-(4-nitrophenyl-2,3,5,6-d4)-, p-acetamino nitrobenzene, AC1Q5MEP, Maybridge1_001346, WLN: WNR DMV1, 4-Nitroacetanilide, 98%, N-(p-Nitrophenyl)acetamide, 4-(Acetylamino)nitrobenzene, AC1L1PC3, N-Acetyl-4-nitrobenzenamine, ACMC-1C41B, 1-Nitro-4-acetylaminobenzene, 4\'-NITROACETANILIDE, N-(4-nitrophenyl)-acetamide, ARONIS23973, SCHEMBL642700, Acetamide,N-(4-nitrophenyl)-, N-(4-Nitro-phenyl)-acetamide, ARONIS023787, CHEMBL131469, DTXSID5059290, CTK2F4289, HMS545F04, NSC1315, Acetanilide, 4'-nitro- (8CI), N-(4-nitrophenyl)ethanimidic acid, KS-000046ER, NSC-1315, 0948AA, ANW-15019, LABOTEST-BB LT00455738, LABOTEST-BB LT03330920, SBB058050, STK004304, ZINC16321384, AKOS003237246, AS00883, MCULE-4712987402, VZ27409, AJ-68853, AN-24667, LS-10807, DB-040507, ST2419665, FT-0619197, N0108, ST45053120, 10.14272/NQRLPDFELNCFHW-UHFFFAOYSA-N, doi:10.14272/NQRLPDFELNCFHW-UHFFFAOYSA-N, I01-7155, J-640230, J-800231, W-109385, 1-Nitro-4-acetylaminobenzene;N-(4-nitrophenyl)acetamide, nitroacetanilide, 4'-nitroacetanilid, C8H8N2O3, C8H4D4N2O3, CID7691, 4-(Dimethylamino)phenyl isocyanate, C8-H8-N2-O3, C8-H4-D4-N2-O3, EINECS 269-437-4, AR-1G3926, A1894, N-(4-nitro[2,3,5,6-2H4]phenyl)acetamide, 4'-Nitro-2',3',5',6'-tetradeuteroacetanilide, 68239-25-8, 6929-42-6,

Complexity	204
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	180.053g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	180.163g/mol
Monoisotopic Mass	180.053g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	74.9A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.7

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

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