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20808-97-3 | 1-Propanone, 1-[2-[2-(dimethylamino)ethoxy]-4-methoxyphenyl]-, hydrochloride (1:1)
CAS No: 20808-97-3 Catalog No: AG002JGZ MDL No:
Product Description
Catalog Number:
AG002JGZ
Chemical Name:
1-Propanone, 1-[2-[2-(dimethylamino)ethoxy]-4-methoxyphenyl]-, hydrochloride (1:1)
CAS Number:
20808-97-3
Molecular Formula:
C14H22ClNO3
Molecular Weight:
287.7824
IUPAC Name:
1-[2-[2-(dimethylamino)ethoxy]-4-methoxyphenyl]propan-1-one;hydrochloride
InChI:
InChI=1S/C14H21NO3.ClH/c1-5-13(16)12-7-6-11(17-4)10-14(12)18-9-8-15(2)3;/h6-7,10H,5,8-9H2,1-4H3;1H
InChI Key:
HVWWAHOZLWHVIL-UHFFFAOYSA-N
SMILES:
CCC(=O)c1ccc(cc1OCCN(C)C)OC.Cl
Properties
Complexity:
255
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
287.129g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
287.784g/mol
Monoisotopic Mass:
287.129g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
38.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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