AG003FSY

3669-41-8 | 1-(2,4-Dihydroxyphenyl)-2-phenylethanone

AG003FSY

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CAS Number	3669-41-8
Catalog Number	AG003FSY(AGN-PC-0JMPU6)
Chemical Name	1-(2,4-Dihydroxyphenyl)-2-phenylethanone
IUPAC Name	1-(2,4-dihydroxyphenyl)-2-phenylethanone
InChI	InChI=1S/C14H12O3/c15-11-6-7-12(14(17)9-11)13(16)8-10-4-2-1-3-5-10/h1-7,9,15,17H,8H2
InChI Key	VFQKAJVKZKHVPD-UHFFFAOYSA-N
MDL Number	MFCD00043754
Molecular Formula	C14H12O3
Molecular Weight	228.2433
NSC Number	105542
SMILES	OC1=CC=C(C(CC2=CC=CC=C2)=O)C(O)=C1
Synonyms	3669-41-8, 1-(2,4-Dihydroxyphenyl)-2-phenylethanone, 2',4'-Dihydroxy-2-phenylacetophenone, Benzyl 2,4-dihydroxyphenyl ketone, 1-(2,4-dihydroxyphenyl)-2-phenylethan-1-one, 2,4-Dihydroxyphenylbenzyl ketone, 2,4-dihydroxydeoxybenzoin, MLS002703836, VFQKAJVKZKHVPD-UHFFFAOYSA-N, NSC105542, FR-1322, EN300-37038, NSC 105542, ACMC-20aod0, AC1L3BUS, CBMicro_026224, AC1Q78MB, Cambridge id 5938997, NCIOpen2_007155, Oprea1_277210, Oprea1_343873, SCHEMBL146018, Benzyl2,4-DihydroxyphenylKetone, Jsp006520, CHEMBL1900501, CTK4H6989, DTXSID80190135, 2,4-dihydroxyphenyl benzyl ketone, ZINC117559, KS-000012NS, ZX-AT027612, IMED57203849, MFCD00043754, SBB008378, STK922923, AKOS000273166, ACM3669418, MCULE-2769985651, NSC-105542, VZ20817, 2\',4\'-Dihydroxy-2-phenylacetophenone, AC-26567, AJ-11531, AK113378, Benzyl 2,4-dihydroxyphenyl ketone, 97%, CC-01776, SMR001570550, ZB003916, BIM-0026207.P001, AX8066913, TR-014987, 1-(2,4-dihydroxyphenyl)-2-phenyl-ethanone, FT-0622795, ST50071707, Z2445, 1-(2,4-Dihydroxy-phenyl)-2-phenyl-ethanone, 1-(2,4-Dihydroxyphenyl)-2-phenylethanone #, Ethanone,1-(2,4-dihydroxyphenyl)-2-phenyl-, A-7546, 1-[2,4-bis(oxidanyl)phenyl]-2-phenyl-ethanone, 669D418, A823330, C-13077, SR-01000223917, SR-01000223917-1, F0758-0023, C14H12O3, CID138005, ACN-034345, B3921,

Complexity	258
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	228.079g/mol
Formal Charge	0
Heavy Atom Count	17
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	228.247g/mol
Monoisotopic Mass	228.079g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	57.5A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3

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

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