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110199-17-2 | (R)-4-Benzylthiazolidine-2-thione
CAS No: 110199-17-2 Catalog No: AG003CA7 MDL No:MFCD06658217
Product Description
Catalog Number:
AG003CA7
Chemical Name:
(R)-4-Benzylthiazolidine-2-thione
CAS Number:
110199-17-2
Molecular Formula:
C10H11NS2
Molecular Weight:
209.3310
MDL Number:
MFCD06658217
IUPAC Name:
(4R)-4-benzyl-1,3-thiazolidine-2-thione
InChI:
InChI=1S/C10H11NS2/c12-10-11-9(7-13-10)6-8-4-2-1-3-5-8/h1-5,9H,6-7H2,(H,11,12)/t9-/m1/s1
InChI Key:
SLDUGQISGRPGAW-SECBINFHSA-N
SMILES:
S=C1SC[C@H](N1)Cc1ccccc1
Properties
Complexity:
187
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
209.033g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
209.325g/mol
Monoisotopic Mass:
209.033g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
69.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9
Literature
| Title | Journal |
|---|---|
| Structural and mechanistic insights into polyketide macrolactonization from polyketide-based affinity labels. | Nature chemical biology 20061001 |
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