AG00034M

1009-61-6 | Ethanone, 1,1'-(1,4-phenylene)bis-

AG00034M

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CAS Number	1009-61-6
Catalog Number	AG00034M(AGN-PC-0JKBFM)
Chemical Name	Ethanone, 1,1'-(1,4-phenylene)bis-
EC Number	213-769-4
IUPAC Name	1-(4-acetylphenyl)ethanone
InChI	InChI=1S/C10H10O2/c1-7(11)9-3-5-10(6-4-9)8(2)12/h3-6H,1-2H3
InChI Key	SKBBQSLSGRSQAJ-UHFFFAOYSA-N
MDL Number	MFCD00008750
Molecular Formula	C10H10O2
Molecular Weight	162.1852
NSC Number	295548
SMILES	C(C)(=O)C1=CC=C(C=C1)C(C)=O
Synonyms	1,4-Diacetylbenzene, 1009-61-6, 1,1'-(1,4-phenylene)diethanone, p-Diacetylbenzene, p-Acetylacetophenone, Benzene, p-diacetyl-, Ethanone, 1,1'-(1,4-phenylene)bis-, 1-(4-acetylphenyl)ethanone, 1-(4-Acetylphenyl)ethan-1-one, SKBBQSLSGRSQAJ-UHFFFAOYSA-N, 1,1-(1,4-Phenylene)bis-ethanone, FR-2298, J-503972, EINECS 213-769-4, 4-Acetylacetophenone, 4'-Acetylacetophenone, NSC 295548, PubChem3143, ACMC-1BWLG, DSSTox_CID_1657, 1-(4-acetylphenyl)ethanon, p-ACETYL ACETOPHENONE, DSSTox_RID_76269, DSSTox_GSID_21657, SCHEMBL50646, 1,4-Diacetylbenzene, 99%, 1-(4-acetylphenyl)-ethanone, 1-(4-ethanoylphenyl)ethanone, Benzene, p-diacetyl- (8CI), 1-(4-Acetyl-phenyl)-ethanone, AC1L22P5, CHEMBL3186189, DTXSID7021657, CTK3J9396, Ethanone,1'-(1,4-phenylene)bis-, ZINC2026195, ZX-AT015227, Tox21_201219, ANW-14405, MFCD00008750, NSC295548, SBB008588, AKOS003628600, Ethanone,1,1'-(1,4-phenylene)bis-, FCH1114378, MCULE-6429827613, NSC-295548, OR59988, RP22519, RTR-000280, NCGC00248961-01, NCGC00258771-01, AJ-32839, AK114027, AN-48299, CC-03300, SC-65431, ST092348, CAS-1009-61-6, AX8000050, BB0295855, TR-000280, D0066, FT-0606830, ST24032121, A800303, C-04213, I01-5794, InChI=1/C10H10O2/c1-7(11)9-3-5-10(6-4-9)8(2)12/h3-6H,1-2H, alpha-Methylhydrocinnamic acid, C10H10O2, CID13888, C10-H10-O2, 1,4-Diacetylbenzene, 99% - 25G 25g,

Complexity	166
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	162.068g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	162.188g/mol
Monoisotopic Mass	162.068g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	34.1A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.3

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

Lot Number