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829-36-7 | Thiazolidine, 2-(4-methoxyphenyl)-, hydrochloride
CAS No: 829-36-7 Catalog No: AG00549H MDL No:
Product Description
Catalog Number:
AG00549H
Chemical Name:
Thiazolidine, 2-(4-methoxyphenyl)-, hydrochloride
CAS Number:
829-36-7
Molecular Formula:
C10H14ClNOS
Molecular Weight:
231.7423
IUPAC Name:
2-(4-methoxyphenyl)-1,3-thiazolidine;hydrochloride
InChI:
InChI=1S/C10H13NOS.ClH/c1-12-9-4-2-8(3-5-9)10-11-6-7-13-10;/h2-5,10-11H,6-7H2,1H3;1H
InChI Key:
IYRNWOPALBBDKC-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1)C1NCCS1.Cl
Properties
Complexity:
157
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
231.048g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
231.738g/mol
Monoisotopic Mass:
231.048g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
46.6A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
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