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896675-61-9 | 2-(2,4,5-Trimethoxyphenyl)-1,3-thiazolidine
CAS No: 896675-61-9 Catalog No: AG01AR3C MDL No:MFCD08138302
Product Description
Catalog Number:
AG01AR3C
Chemical Name:
2-(2,4,5-Trimethoxyphenyl)-1,3-thiazolidine
CAS Number:
896675-61-9
Molecular Formula:
C12H17NO3S
Molecular Weight:
255.3333
MDL Number:
MFCD08138302
IUPAC Name:
2-(2,4,5-trimethoxyphenyl)-1,3-thiazolidine
InChI:
InChI=1S/C12H17NO3S/c1-14-9-7-11(16-3)10(15-2)6-8(9)12-13-4-5-17-12/h6-7,12-13H,4-5H2,1-3H3
InChI Key:
RJQAJSKREVOHBA-UHFFFAOYSA-N
SMILES:
COc1cc(OC)c(cc1C1NCCS1)OC
Properties
Complexity:
242
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
255.093g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
255.332g/mol
Monoisotopic Mass:
255.093g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
65A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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