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10603-84-6 | Benzothiazole, 2-[(tributylstannyl)thio]-
CAS No: 10603-84-6 Catalog No: AG0084HG MDL No:
Product Description
Catalog Number:
AG0084HG
Chemical Name:
Benzothiazole, 2-[(tributylstannyl)thio]-
CAS Number:
10603-84-6
Molecular Formula:
C19H31NS2Sn
Molecular Weight:
456.2871
IUPAC Name:
1,3-benzothiazol-2-ylsulfanyl(tributyl)stannane
InChI:
InChI=1S/C7H5NS2.3C4H9.Sn/c9-7-8-5-3-1-2-4-6(5)10-7;3*1-3-4-2;/h1-4H,(H,8,9);3*1,3-4H2,2H3;/q;;;;+1/p-1
InChI Key:
IFERELZGVILZDB-UHFFFAOYSA-M
SMILES:
CCCC[Sn](Sc1nc2c(s1)cccc2)(CCCC)CCCC
Properties
Complexity:
305
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
457.092g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
456.294g/mol
Monoisotopic Mass:
457.092g/mol
Rotatable Bond Count:
11
Topological Polar Surface Area:
66.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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