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67189-39-3 | 2-(3,4-dimethoxyphenyl)-1,3-thiazolidine
CAS No: 67189-39-3 Catalog No: AG0197JT MDL No:MFCD00805019
Product Description
Catalog Number:
AG0197JT
Chemical Name:
2-(3,4-dimethoxyphenyl)-1,3-thiazolidine
CAS Number:
67189-39-3
Molecular Formula:
C11H15NO2S
Molecular Weight:
225.3073
MDL Number:
MFCD00805019
IUPAC Name:
2-(3,4-dimethoxyphenyl)-1,3-thiazolidine
InChI:
InChI=1S/C11H15NO2S/c1-13-9-4-3-8(7-10(9)14-2)11-12-5-6-15-11/h3-4,7,11-12H,5-6H2,1-2H3
InChI Key:
SEBSCXLWNCIHNW-UHFFFAOYSA-N
SMILES:
COc1cc(ccc1OC)C1NCCS1
Properties
Complexity:
203
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
225.082g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
225.306g/mol
Monoisotopic Mass:
225.082g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
55.8A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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