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68052-20-0 | ETHYL (3,4-DIMETHOXYPHENYL)IMINOACETATE HYDROCHLORIDE
CAS No: 68052-20-0 Catalog No: AG006G9E MDL No:
Product Description
Catalog Number:
AG006G9E
Chemical Name:
ETHYL (3,4-DIMETHOXYPHENYL)IMINOACETATE HYDROCHLORIDE
CAS Number:
68052-20-0
Molecular Formula:
C12H16ClNO4
Molecular Weight:
273.7127
IUPAC Name:
ethyl 2-(3,4-dimethoxyphenyl)-2-iminoacetate;hydrochloride
InChI:
InChI=1S/C12H15NO4.ClH/c1-4-17-12(14)11(13)8-5-6-9(15-2)10(7-8)16-3;/h5-7,13H,4H2,1-3H3;1H
InChI Key:
WRYHGHYANGDBOG-UHFFFAOYSA-N
SMILES:
CCOC(=O)C=Nc1ccc(c(c1)OC)OC.Cl
EC Number:
268-313-7
Properties
Complexity:
280
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
273.077g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
273.713g/mol
Monoisotopic Mass:
273.077g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
68.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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