AG007077

451-40-1 | 1,2-Diphenylethanone

AG007077

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CAS Number	451-40-1
Catalog Number	AG007077(AGN-PC-0CNLUS)
Chemical Name	1,2-Diphenylethanone
EC Number	207-193-2
IUPAC Name	1,2-diphenylethanone
InChI	InChI=1S/C14H12O/c15-14(13-9-5-2-6-10-13)11-12-7-3-1-4-8-12/h1-10H,11H2
InChI Key	OTKCEEWUXHVZQI-UHFFFAOYSA-N
MDL Number	MFCD27966903
Molecular Formula	C14H12O
Molecular Weight	196.2445
SMILES	C1(=CC=CC=C1)C(CC1=CC=CC=C1)=O
UNII	F17V6C9PZX
Synonyms	deoxybenzoin, Deoxybenzoin, 1,2-Diphenylethanone, 2-Phenylacetophenone, 451-40-1, Benzyl phenyl ketone, Ethanone, 1,2-diphenyl-, DESOXYBENZOIN, 1,2-Diphenylethan-1-one, Phenyl benzyl ketone, Benzoin, deoxy-, Acetophenone, 2-phenyl-, deoxy benzoin, UNII-F17V6C9PZX, a-phenylacetophenone, 1,2-diphenyl-ethanone, EINECS 207-193-2, NSC 131456, BRN 1072876, F17V6C9PZX, AI3-10583, OTKCEEWUXHVZQI-UHFFFAOYSA-N, MFCD00003081, Deoxybenzoin, 98%, WLN: RV1R, F3297-0011, desoxybenzoine, benzylphenylketone, BzBn, alpha-phenylacetophenone, 1, 2-diphenylethanone, 1,2 diphenyl ethanone, 1,2 diphenyl-ethanone, Enamine_004883, AC1Q5GZL, AC1Q5GZM, ACMC-1AJF1, 1,2-Diphenyl-1-ethanone, AC1L1U5T, 2-Phenylacetophenone, 97%, DSSTox_CID_24430, DSSTox_RID_80222, DSSTox_GSID_44430, SCHEMBL24800, 4-07-00-01393 (Beilstein Handbook Reference), KSC236O3D, CHEMBL3182695, DTXSID6044430, CTK1D6731, NSC6097, HMS1407N21, KS-000000BQ, NSC-6097, ZINC1504261, Tox21_302159, ANW-30216, NSC131456, NSC249236, SBB069474, STL264189, AKOS001050203, CCG-103088, LS10754, MCULE-1900838211, NE10262, NSC-131456, NSC-249236, RTR-017210, NCGC00255911-01, AC-11645, AJ-26419, AK-58950, AN-44957, AS-11947, CAS-451-40-1, CJ-23738, LS-13697, SY010613, Benzyl phenyl ketone, 2-Phenylacetophenone, AB1003524, DB-051270, TR-017210, B0435, EU-0066752, FT-0624508, ST24036729, ST50186819, EN300-17086, MFCD00003081 (98%), A826725, AH-034/32462010, SR-01000388911, S14-0861, SR-01000388911-1, W-106163, Z56876371, Deoxybenzoin; Benzyl phenyl ketone; alpha-Phenylacetophenone, 13892-81-4, InChI=1/C14H12O/c15-14(13-9-5-2-6-10-13)11-12-7-3-1-4-8-12/h1-10H,11H, Ethanone,2-diphenyl-, C14H12O, CID9948, C14-H12-O, 2-Phenylacetophenone, 97% - 100G 100g,

Complexity	197
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	196.089g/mol
Formal Charge	0
Heavy Atom Count	15
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	196.249g/mol
Monoisotopic Mass	196.089g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	17.1A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3.2

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

Lot Number