AG003I7Q

2125-49-7 | 3-(Dimethylamino)-1-(4-methoxyphenyl)-propan-1-one, HCl

AG003I7Q

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CAS Number	2125-49-7
Catalog Number	AG003I7Q(AGN-PC-0JLROE)
Chemical Name	3-(Dimethylamino)-1-(4-methoxyphenyl)-propan-1-one, HCl
IUPAC Name	3-(dimethylamino)-1-(4-methoxyphenyl)propan-1-one;hydrochloride
InChI	InChI=1S/C12H17NO2.ClH/c1-13(2)9-8-12(14)10-4-6-11(15-3)7-5-10;/h4-7H,8-9H2,1-3H3;1H
InChI Key	WWMSOMMTYFMTPL-UHFFFAOYSA-N
MDL Number	MFCD00156682
Molecular Formula	C12H18ClNO2
Molecular Weight	243.7298
SMILES	O=C(C1=CC=C(OC)C=C1)CCN(C)C.[H]Cl
Synonyms	2125-49-7, 3-(Dimethylamino)-1-(4-methoxyphenyl)-propan-1-one Hydrochloride, 1-Propanone, 3-(dimethylamino)-1-(4-methoxyphenyl)-, hydrochloride, 3-(dimethylamino)-1-(4-methoxyphenyl)propan-1-one hydrochloride(1:1), 3-(Dimethylamino)-4'-methylpropiophenone hydrochloride, 3-(dimethylamino)-1-(4-methoxyphenyl)propan-1-one hydrochloride, A-22, 3-(dimethylamino)-1-(4-methoxyphenyl)-1-Propanone hydrochloride, 3-(Dimethylamino)-4'-methoxypropiophenone hydrochloride, Propiophenone, 3-(dimethylamino)-4'-methyl-, hydrochloride, Propiophenone, 3-(dimethylamino)-4'-methoxy-, hydrochloride, NSC692750, AC1L2W8A, AC1Q3DU0, Cambridge id 5107939, SCHEMBL5954694, CHEMBL3337636, CTK8D5832, NSC16580, 7212AD, MFCD00156682, NSC-16580, AKOS024438643, AC-7107, ACM2125497, AN-9308, NSC-692750, TRA0039862, KS-00000C01, SC-24894, SY004000, AB0059412, DB-066463, LS-125190, LS-125194, TC-257560, FT-0711361, K-6108, MFCD00156682 (97+%), SR-01000393158, SR-01000393158-1, 3-(Dimethylamino)-1-(4-methoxyphenyl)-propan-1-one, 3-(Dimethylamino)-1-(4-methoxyphenyl)-propan-1-one, HCl, 3-(DIMETHYLAMINO)-1-(4-METHOXYPHENYL)-PROPAN-1-ONE HCL, 3-(Dimethylamino)-1-(4-methoxyphenyl)-propan-1-oneHydrochloride, 3-(dimethylamino)-1-(4-methoxyphenyl)propan-1-one;hydrochloride, C12H18ClNO2, CID78910, AR-1E7557, 3- -N,N-DIMETHYL-3-OXO-1-PROPANAMINIUMCHLORIDE, 1-Propanone, 3-(dimethylamino)-1-(4-methylphenyl)-, hydrochloride, 3-(Dimethylamino)-1-(4-methylphenyl)propan-1-one Hydrochloride, 5250-02-2, 5412-02-2,

Complexity	196
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	2
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	243.103g/mol
Formal Charge	0
Heavy Atom Count	16
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	243.731g/mol
Monoisotopic Mass	243.103g/mol
Rotatable Bond Count	5
Topological Polar Surface Area	29.5A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H335
Packing Group
Precautionary statements	P280-P305+P351+P338
UN Code

Certificate of Analysis

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