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77771-20-1 | 2,2'-bithiazolidine
CAS No: 77771-20-1 Catalog No: AG0057S9 MDL No:
Product Description
Catalog Number:
AG0057S9
Chemical Name:
2,2'-bithiazolidine
CAS Number:
77771-20-1
Molecular Formula:
C6H12N2S2
Molecular Weight:
176.3029
IUPAC Name:
2-(1,3-thiazolidin-2-yl)-1,3-thiazolidine
InChI:
InChI=1S/C6H12N2S2/c1-3-9-5(7-1)6-8-2-4-10-6/h5-8H,1-4H2
InChI Key:
BALPQDWQADEPOU-UHFFFAOYSA-N
SMILES:
C1CSC(N1)C1NCCS1
NSC Number:
84099
Properties
Complexity:
106
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
176.044g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
176.296g/mol
Monoisotopic Mass:
176.044g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
74.7A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5
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