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67036-42-4 | Indolizine, 2,3-bis[(1,1-dimethylethyl)thio]-5,6,7,8-tetrahydro-
CAS No: 67036-42-4 Catalog No: AG006MLM MDL No:
Product Description
Catalog Number:
AG006MLM
Chemical Name:
Indolizine, 2,3-bis[(1,1-dimethylethyl)thio]-5,6,7,8-tetrahydro-
CAS Number:
67036-42-4
Molecular Formula:
C16H27NS2
Molecular Weight:
297.5223
IUPAC Name:
2,3-bis(tert-butylsulfanyl)-5,6,7,8-tetrahydroindolizine
InChI:
InChI=1S/C16H27NS2/c1-15(2,3)18-13-11-12-9-7-8-10-17(12)14(13)19-16(4,5)6/h11H,7-10H2,1-6H3
InChI Key:
VHEQRLBQWLDLNC-UHFFFAOYSA-N
SMILES:
CC(Sc1c(cc2n1CCCC2)SC(C)(C)C)(C)C
Properties
Complexity:
303
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
297.158g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
297.519g/mol
Monoisotopic Mass:
297.158g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
55.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.7
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