AG00IB68

6322-56-1 | Ethanone, 1-(4-hydroxy-3-nitrophenyl)-

AG00IB68

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CAS Number	6322-56-1
Catalog Number	AG00IB68(AGN-PC-0JMQB7)
Chemical Name	Ethanone, 1-(4-hydroxy-3-nitrophenyl)-
IUPAC Name	1-(4-hydroxy-3-nitrophenyl)ethanone
InChI	InChI=1S/C8H7NO4/c1-5(10)6-2-3-8(11)7(4-6)9(12)13/h2-4,11H,1H3
InChI Key	MMNKVWGVSHRIJL-UHFFFAOYSA-N
MDL Number	MFCD00017002
Molecular Formula	C8H7NO4
Molecular Weight	181.1455
NSC Number	32113
SMILES	CC(C1=CC=C(O)C([N+]([O-])=O)=C1)=O
Synonyms	4'-Hydroxy-3'-nitroacetophenone, 6322-56-1, 4-Hydroxy-3-Nitroacetophenone, 1-(4-hydroxy-3-nitrophenyl)ethanone, 4-acetyl-2-nitro-phenol, 1-(4-hydroxy-3-nitrophenyl)ethan-1-one, 1-(4-hydroxy-3-nitrophenyl)-1-ethanone, 2-nitro-4-acetylphenol, 4-Acetyl-2-nitrophenol, MFCD00017002, Ethanone, 1-(4-hydroxy-3-nitrophenyl)-, MMNKVWGVSHRIJL-UHFFFAOYSA-N, 1-(4-hydroxy-3-nitro-phenyl)ethanone, 1-acetyl-4-hydroxy-3-nitrobenzene, 1-[4-Hydroxy-3-nitrophenyl]ethanone, 3'-nitro-4'-hydroxyacetophenone, NSC32113, PubChem4261, AC1L3DFY, ACMC-1B9XX, KSC618C9J, 3-nitro-4-hydroxyacetophenone, SCHEMBL532487, 4-hydroxy 3-nitro acetophenone, SCHEMBL17347336, CTK5B8194, KS-00000JKP, 4;-Hydroxy-3;-nitroacetophenone, DTXSID60212586, 4'-hydroxy-3'-nitro acetophenone, 4'-hydroxy-3'-nitroaceto phenone, ACT01023, ZINC1664679, 4\'-Hydroxy-3\'-nitroacetophenone, ANW-34587, BBL023558, NSC-32113, SBB063198, STL282767, AKOS000446959, AC-4826, AS05199, CS-W017168, HB-0708, MCULE-2520513448, RP10899, RTR-021784, VZ27384, 1-(4-hydroxy-3-nitro-phenyl)-ethanone, 4'-Hydroxy-3'-nitroacetophenone, 98%, Ethanone,1-(4-hydroxy-3-nitrophenyl)-, AJ-28972, AK-44040, AN-11578, BR-44040, Q223, SC-05963, AB0017462, AB1008046, TR-021784, A8720, AM20050378, FT-0618643, ST24023010, ST45024970, 22H561, A-2116, I01-0808, J-503324, 1-(4-hydroxy-3-nitrophenyl)ethanone;4-Acetyl-2-nitro-phenol, null, C8H7NO4, 3-Nitro-4-hydroxyacttophenone, CID138723, H0968, 4'-Hydroxy-3'-nitroacetophenone, 98% - 1G 1g,

Complexity	223
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	181.038g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	181.147g/mol
Monoisotopic Mass	181.038g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	83.1A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.5

GHS Hazard and Precautionary Statements

Symbol:
Hazard statements	H315-H319-H335
Precuationary statements	P261-P305+P351+P338
Siginal words

Certificate of Analysis

Lot Number