AG00EBBG

60609-65-6 | 3',5'-Dimethyl-4'-methoxyacetophenone

AG00EBBG

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CAS Number	60609-65-6
Catalog Number	AG00EBBG(AGN-PC-0KKMLU)
Chemical Name	3',5'-Dimethyl-4'-methoxyacetophenone
IUPAC Name	1-(4-methoxy-3,5-dimethylphenyl)ethanone
InChI	InChI=1S/C11H14O2/c1-7-5-10(9(3)12)6-8(2)11(7)13-4/h5-6H,1-4H3
InChI Key	OZNRJDZKCCJUJO-UHFFFAOYSA-N
MDL Number	MFCD06201228
Molecular Formula	C11H14O2
Molecular Weight	178.2277
SMILES	CC(C1=CC(C)=C(OC)C(C)=C1)=O
Synonyms	3',5'-Dimethyl-4'-methoxyacetophenone, 60609-65-6, 1-(4-methoxy-3,5-dimethylphenyl)ethanone, 4'-Methoxy-3',5'-dimethylacetophenone, 1-(4-methoxy-3,5-dimethylphenyl)ethan-1-one, Ethanone, 1-(4-methoxy-3,5-dimethylphenyl)-, AC1MBYGS, KSC497G1F, SCHEMBL2796551, CTK3J7312, DTXSID40374398, 3,5-Dimethyl-4-methoxyacetophenone, ALBB-004403, KS-000010VE, ZINC4255635, 9052AB, ANW-44428, CL8650, STK288942, AKOS000299288, FS-1702, MCULE-6279732399, RTC-030854, AJ-49758, CJ-11705, DB-006311, TC-030854, FT-0080577, FT-0650904, R9091, ST24028149, C11H14O2, 3,5-Dimethyl-4-Methoxybenzaldehyde, ZINC04255635, CID2758572, 39250-90-3,

Complexity	177
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	178.099g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	178.231g/mol
Monoisotopic Mass	178.099g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	26.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.3

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302
Packing Group
Precautionary statements	P280-P305+P351+P338
Signal Words	warning
UN Code

Certificate of Analysis

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