AG00298K

2040-04-2 | Ethanone, 1-(2,6-dimethoxyphenyl)-

AG00298K

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CAS Number	2040-04-2
Catalog Number	AG00298K(AGN-PC-0JKCS3)
Chemical Name	Ethanone, 1-(2,6-dimethoxyphenyl)-
EC Number	218-034-1
IUPAC Name	1-(2,6-dimethoxyphenyl)ethanone
InChI	InChI=1S/C10H12O3/c1-7(11)10-8(12-2)5-4-6-9(10)13-3/h4-6H,1-3H3
InChI Key	XEUGKOFTNAYMMX-UHFFFAOYSA-N
MDL Number	MFCD00008729
Molecular Formula	C10H12O3
Molecular Weight	180.2005
SMILES	CC(C1=C(OC)C=CC=C1OC)=O
Synonyms	2',6'-Dimethoxyacetophenone, 2040-04-2, 1-(2,6-DIMETHOXYPHENYL)ETHANONE, 2,6-Dimethoxyacetophenone, Acetophenone, 2',6'-dimethoxy-, 1-(2,6-Dimethoxyphenyl)ethan-1-one, Ethanone, 1-(2,6-dimethoxyphenyl)-, USAF K-2801, 2,6-Dimethoxy Acetophenone, XEUGKOFTNAYMMX-UHFFFAOYSA-N, EINECS 218-034-1, 2',6'-Dimethoxyacetophenone, 98%, BRN 2048976, 1-acetyl-2,6-dimethoxybenzene, PubChem3380, ACMC-20ao8c, AC1L27LN, AC1Q4E8W, BIDD:ER0408, SCHEMBL598460, CHEMBL3274358, CTK4E4121, DTXSID10174347, ZINC330167, ALBB-006380, KS-000017NO, 1-(2,6-dimethoxy-phenyl)-ethanone, 1-(2,6-Dimethoxyphenyl)ethanone #, BBL013937, Ethanone,1-(2,6-dimethoxyphenyl)-, HTS001835, SBB048181, STK500919, AKOS000299254, AS04644, BS-3973, MCULE-9737552753, VZ21821, AJ-19299, AK153086, LS-13510, P363, SY048723, ZB010495, DB-020220, TR-009516, 2',6'-Dihydroxyacetophenone, dimethyl ether, CS-0031663, D4849, FT-0633988, R1203, ST24037036, ST50331350, Ethanone, 1-(2,6-dimethoxyphenyl)- (9CI), MFCD00008729 (97%), 40D042, 4-08-00-01811 (Beilstein Handbook Reference), AB-131/40897142, A1-00326, W-107624, I14-28954, 2 inverted exclamation mark ,6 inverted exclamation mark -Dimethoxyacetophenone, AIDS017985, C10H12O3, CID16267, MFCD00008729,

Complexity	167
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	180.079g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	180.203g/mol
Monoisotopic Mass	180.079g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	35.5A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.2

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

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