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123464-63-1 | Ethanone, 2-amino-1-(2,4-dimethoxyphenyl)-, hydrochloride (9CI)
CAS No: 123464-63-1 Catalog No: AG000KO8 MDL No:MFCD08692496
Product Description
Catalog Number:
AG000KO8
Chemical Name:
Ethanone, 2-amino-1-(2,4-dimethoxyphenyl)-, hydrochloride (9CI)
CAS Number:
123464-63-1
Molecular Formula:
C10H14ClNO3
Molecular Weight:
231.6761
MDL Number:
MFCD08692496
IUPAC Name:
[2-(2,4-dimethoxyphenyl)-2-oxoethyl]azanium;chloride
InChI:
InChI=1S/C10H13NO3.ClH/c1-13-7-3-4-8(9(12)6-11)10(5-7)14-2;/h3-5H,6,11H2,1-2H3;1H
InChI Key:
LEEHGZWQGVPBJU-UHFFFAOYSA-N
SMILES:
NCC(=O)c1ccc(cc1OC)OC.Cl
Properties
Complexity:
196
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
231.066g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
231.676g/mol
Monoisotopic Mass:
231.066g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
63.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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