AG000689

102-04-5 | 2-Propanone, 1,3-diphenyl-

AG000689

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CAS Number	102-04-5
Catalog Number	AG000689(AGN-PC-0JK85U)
Chemical Name	2-Propanone, 1,3-diphenyl-
EC Number	203-000-0
FEMA Number	2397
IUPAC Name	1,3-diphenylpropan-2-one
InChI	InChI=1S/C15H14O/c16-15(11-13-7-3-1-4-8-13)12-14-9-5-2-6-10-14/h1-10H,11-12H2
InChI Key	YFKBXYGUSOXJGS-UHFFFAOYSA-N
MDL Number	MFCD00004795
Molecular Formula	C15H14O
Molecular Weight	210.2711
SMILES	O=C(Cc1ccccc1)Cc2ccccc2
UNII	9Y07G5UDKQ
Synonyms	1,3-Diphenylacetone, 102-04-5, DIBENZYL KETONE, 1,3-diphenylpropan-2-one, 1,3-Diphenyl-2-propanone, Benzyl ketone, 2-Propanone, 1,3-diphenyl-, 1,3-Diphenylpropanone, alpha,alpha'-Diphenylacetone, 1,3-Diphenyl-propan-2-one, UNII-9Y07G5UDKQ, MFCD00004795, NSC 220312, FEMA No. 2397, .alpha.,.alpha.'-Diphenylacetone, EINECS 203-000-0, 9Y07G5UDKQ, AI3-05001, YFKBXYGUSOXJGS-UHFFFAOYSA-N, AK158939, 2-Propanone,3-diphenyl-, D-6110, D-6112, 1,3-Diphenylacetone, 99%, dibenzylketone, 1,3 diphenyl acetone, AC1Q5GZV, ACMC-2097zy, SCHEMBL77563, KSC176C1P, AC1L1P47, Jsp000258, CHEMBL4083314, DTXSID5059244, CTK0H6117, FEMA 2397, NSC4577, 1,3-Diphenylacetone, 97.0%+, 1,3-Diphenyl-2-propanone, 99%, NSC-4577, ZINC1679978, ANW-14636, NSC220312, NSC407392, SBB058726, AKOS000120284, LS10590, MCULE-7586382749, NSC-220312, NSC-407392, OR52322, RP26570, RTR-000537, TRA0016111, KS-0000017D, AJ-29589, AN-24595, AS-11950, CC-03186, CJ-27532, SC-15333, ST075009, SY010646, 1,3-Diphenyl-2-propanone, >=98%, FG, AX8041106, BC4134498, LS-122972, ST2402997, TR-000537, D0911, FT-0084417, FT-0606713, MFCD00004795 (95%), K-0280, A800503, C-34010, I01-3999, 1,3-Diphenyl-2-propanone, purum, >=98.0% (GC), F0001-0066, Z1258943246, 1,3-diphenylpropan-2-on, C15H14O, CID7593, 1,3-Diphenylacetone, 98% 25g, C15-H14-O, 1,3-Diphenyl-2-propanone, 99% - 100g 100g,

Complexity	188
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	210.104g/mol
Formal Charge	0
Heavy Atom Count	16
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	210.276g/mol
Monoisotopic Mass	210.104g/mol
Rotatable Bond Count	4
Topological Polar Surface Area	17.1A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3.1

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

Lot Number