AG003IND

51863-60-6 | 3',5'-Dihydroxyacetophenone

AG003IND

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CAS Number	51863-60-6
Catalog Number	AG003IND(AGN-PC-0JLE2D)
Chemical Name	3',5'-Dihydroxyacetophenone
EC Number	257-480-1
IUPAC Name	1-(3,5-dihydroxyphenyl)ethanone
InChI	InChI=1S/C8H8O3/c1-5(9)6-2-7(10)4-8(11)3-6/h2-4,10-11H,1H3
InChI Key	WQXWIKCZNIGMAP-UHFFFAOYSA-N
MDL Number	MFCD06656033
Molecular Formula	C8H8O3
Molecular Weight	152.1473
SMILES	CC(C1=CC(O)=CC(O)=C1)=O
UNII	KP7R433NNR
Synonyms	3',5'-Dihydroxyacetophenone, 51863-60-6, 1-(3,5-Dihydroxyphenyl)ethanone, 3,5-Dihydroxyacetophenone, 5-Acetylresorcinol, 1-(3,5-Dihydroxyphenyl)ethan-1-one, UNII-KP7R433NNR, Ethanone, 1-(3,5-dihydroxyphenyl)-, 1-(3,5-Dihydroxyphenyl)-ethanone, MFCD00002290, KP7R433NNR, CHEMBL507042, WQXWIKCZNIGMAP-UHFFFAOYSA-N, 3',5'-Dihydroxyacetophenone, 97%, 1-acetyl-3,5-dihydroxybenzene, EINECS 257-480-1, PubChem3390, ACMC-209kwf, AC1L2VWP, AC1Q5DIC, 3'5'-dihydroxyacetophenone, 3, 5-dihydroxyacetophenone, 3,5-dihydroxy acetophenone, 3,5-dihydroxy-acetophenone, AC1Q1JN3, 3'-5'-dihydroxyacetophenone, SCHEMBL96189, 3;,5;-Dihydroxyacetophenone, 3',5'-dihydroxy acetophenone, 3'',5''-Dihydroxyacetophenone, CTK1H3536, DTXSID80199825, ACN-S003554, KS-00000C2V, ZINC2242686, 1-(3,5-dihydroxy-phenyl)-ethanone, 1-(3,5-Dihydroxyphenyl)ethanone #, ANW-31357, BBL027376, BDBM50255980, SBB063186, STL373486, 3',5'-Dihydroxyphenyl Methyl Ketone, AKOS007930544, AB00220, AC-1972, FS-1636, MCULE-7845313163, RTC-061364, TRA0046939, VZ25283, 1-(3,5-Dihydroxyphenyl)ethanone, 9CI, AJ-34163, AK-45934, AN-14444, BC201351, BR-45934, CJ-07967, SC-04991, ST094951, SY015793, TL806239, AB0012251, ST2403126, TC-061364, CS-0082526, D1981, FT-0082929, FT-0614618, 63D606, D-3420, M-3162, MFCD00002290 (97+%), I01-0744, F0001-1351, 3 inverted exclamation mark ,5 inverted exclamation mark -Dihydroxyacetophenone, 3 inverted exclamation marka,5 inverted exclamation marka-Dihydroxyacetophenone, InChI=1/C8H8O3/c1-5(9)6-2-7(10)4-8(11)3-6/h2-4,10-11H,1H, Resacetophenone, C8H8O3, 3/',5/'-Dihydroxyacetophenone, KST-1B4896, C8-H8-O3, 1-(3,5-dihydroxyphenyl)-ethanone;, AR-1B1282, CID103993, ZINC02242686, ACN-037624, 3',5'-Dihydroxyacetophenone, 97% - 10G 10g, 5303-37-7,

Complexity	145
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	152.047g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	152.149g/mol
Monoisotopic Mass	152.047g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	57.5A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.9

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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