AG000Q0W

120-46-7 | 1,3-Propanedione, 1,3-diphenyl-

AG000Q0W

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CAS Number	120-46-7
Catalog Number	AG000Q0W(AGN-PC-09SCVN)
Chemical Name	1,3-Propanedione, 1,3-diphenyl-
EC Number	204-398-9
IUPAC Name	1,3-diphenylpropane-1,3-dione
InChI	InChI=1S/C15H12O2/c16-14(12-7-3-1-4-8-12)11-15(17)13-9-5-2-6-10-13/h1-10H,11H2
InChI Key	NZZIMKJIVMHWJC-UHFFFAOYSA-N
MDL Number	MFCD00003085
Molecular Formula	C15H12O2
Molecular Weight	224.2546
NSC Number	6266
SMILES	O=C(C1=CC=CC=C1)CC(C2=CC=CC=C2)=O
UNII	ANS7ME8OKC
Synonyms	dibenzoylmethane, Dibenzoylmethane, 120-46-7, 1,3-Diphenylpropane-1,3-dione, 1,3-DIPHENYL-1,3-PROPANEDIONE, 1,3-Propanedione, 1,3-diphenyl-, 2-Benzoylacetophenone, Phenyl phenacyl ketone, Rhodiastab 83, omega-Benzoylacetophenone, Dibenzoyl-methane, Karenzu DK2, UNII-ANS7ME8OKC, NSC 6266, MFCD00003085, ANS7ME8OKC, EINECS 204-398-9, .omega.-Benzoylacetophenone, BRN 0514910, AI3-19022, CHEBI:75417, NZZIMKJIVMHWJC-UHFFFAOYSA-N, 1,3-Diphenyl-propane-1,3-dione, Dibenzoylmethane, 98%, dibenzoyl methane, phenacyl phenyl ketone, Dibenzoylmethan, CCRIS 8445, Karenzu DK 2, 1, 1,3-diphenyl-, AC1L1QZP, AC1Q5GTX, Spectrum2_000038, Spectrum3_001950, ACMC-209a7j, EC 204-398-9, AC1Q1HE2, DSSTox_CID_21247, DSSTox_RID_79661, DSSTox_GSID_41247, SCHEMBL39582, BSPBio_003550, KSC174Q7F, MLS002695996, SPECTRUM1505311, SPBio_000135, CHEMBL371523, 1,3-diphenyl-1,3-propandione, 1,3-diphenyl-1,3-propanedion, DTXSID3041247, BDBM22727, CTK0H4872, KBio3_002841, NSC6266, 1,3-Diphenyl-Propan-1,3-Dion, HMS3091A20, KS-00000C2Z, NSC-6266, STR01439, ZINC4530702, 1,3-Diphenylpropanedione (Related), Tox21_300686, ANW-17501, CCG-40047, STK372683, AKOS000119639, CS-W010447, MCULE-6320643310, NE10265, RP27517, RTR-003386, TRA0010805, 1,3-Diphenyl-1,3-propanedione, 98%, UPCMLD0ENAT5883819:001, NCGC00095298-01, NCGC00095298-02, NCGC00095298-03, NCGC00095298-04, NCGC00254594-01, AC-11379, AJ-51565, AK-94186, AN-22822, CAS-120-46-7, CJ-12137, M261, SC-19029, SMR001253722, SY014045, DB-041558, LS-120771, TR-003386, AM20020283, D0910, FT-0624640, ST24026765, ST50319429, MFCD00003085 (98%), I14-6007, W-108476, BRD-K01555864-001-02-8, F0001-0329, Z256709078, 1,3-Propanedione, Karenz DK 2, D02BDL, C15H12O2, phenyl-alpha-hydroxystyryl ketone, 1 3-Diphenyl-1 3-propanedione, CID8433, 1,3-propanodiona, 1,3-difenil-, (3-Phenyl-1,3-propandionyl)benzol, AD 158, AR-1L0192, NSC 52984, C15-H12-O2, NSC 406806, Dibenzoylmethane, 98% - 100G 100g, PROPANE-1,3-DIONE, 1,3-DIPHENYL-, C061481, Dibenzoylmethane (chronic inflammatory disease/cancer), DBM, 78686-02-9,

Complexity	243
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	224.084g/mol
Formal Charge	0
Heavy Atom Count	17
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	224.259g/mol
Monoisotopic Mass	224.084g/mol
Rotatable Bond Count	4
Topological Polar Surface Area	34.1A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3.1

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

Lot Number