AG00C11T

40786-69-4 | 2',4'-Dihydroxy-3'-propylacetophenone

AG00C11T

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CAS Number	40786-69-4
Catalog Number	AG00C11T(AGN-PC-0KKWP1)
Chemical Name	2',4'-Dihydroxy-3'-propylacetophenone
IUPAC Name	1-(2,4-dihydroxy-3-propylphenyl)ethanone
InChI	InChI=1S/C11H14O3/c1-3-4-9-10(13)6-5-8(7(2)12)11(9)14/h5-6,13-14H,3-4H2,1-2H3
InChI Key	QGGRBWUQXAFYEC-UHFFFAOYSA-N
MDL Number	MFCD00068616
Molecular Formula	C11H14O3
Molecular Weight	194.2271
SMILES	CC(C1=CC=C(O)C(CCC)=C1O)=O
Synonyms	40786-69-4, 1-(2,4-dihydroxy-3-propylphenyl)ethanone, 2',4'-DIHYDROXY-3'-PROPYLACETOPHENONE, 1-(2,4-Dihydroxy-3-propylphenyl)ethan-1-one, 2,4-Dihydroxy-3-Propylacetophenone, Ethanone, 1-(2,4-dihydroxy-3-propylphenyl)-, (2,4-Dihydroxy-3-n-propylphenyl)ethanone, Ethanone,1-(2,4-dihydroxy-3-propylphenyl)-, J-502911, 1-[2,4-dihydroxy-3-propylphenyl)ethanone, PubChem19225, AC1MCQ1Z, KSC583O6J, SCHEMBL480388, CTK4I3764, DTXSID80379448, QGGRBWUQXAFYEC-UHFFFAOYSA-N, AM987, ZINC157838, CS-M0927, KS-000010EL, ZX-AT009431, 2,4-di-hydroxy-3-propylacetophenone, 2-Propyl-4-acetylbenzene-1,3-diol, 4-acetyl-3-hydroxy-2-propyl phenol, ANW-48672, MFCD00068616, AKOS000278485, AC-9044, AN-7428, AS01153, FCH1117837, OR22025, VZ20816, 2',4'-dihydroxy-3'-propyl acetophenone, 2',4'-dihydroxy-3'-n-propylacetophenone, AJ-15116, AK-49772, AS-31423, BR-49772, CJ-01719, EN002331, ZB006778, AB0024791, AX8000603, DB-049654, RT-002901, ST2403065, TL8002964, 1-(2,4-dihydroxy-3-propyl-phenyl)ethanone, 1-(2,4-dihydroxy-3-propylphenyl) ethanone, 1-(2,4-dihydroxy-3-propylphenyl)-ethanone, 3'-(n-Propyl)-2',4'-Dihydroxyacetophenone, FT-0602150, W6133, 1-(2,4-dihydroxy-3-propyl phenyl) ethanone, 1-(2,4-dihydroxy-3-propyl-phenyl)-ethanone, 2', 4'-dihydroxy-3'-(n-propyl)acetophenone, 2',4'-Dihydroxy-3'-propylacetophenone, 99%, S-1445, 786D694, InChI=1/C11H14O3/c1-3-4-9-10(13)6-5-8(7(2)12)11(9)14/h5-6,13-14H,3-4H2,1-2H, C11H14O3, ZINC00157838, ACN-036560, CID2775198,

Complexity	203
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	194.094g/mol
Formal Charge	0
Heavy Atom Count	14
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	194.23g/mol
Monoisotopic Mass	194.094g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	57.5A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.8

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