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106296-65-5

106296-65-5 | 2-Pentanone, 5-(2-benzothiazolylthio)-5-(trimethylsilyl)-

CAS No: 106296-65-5 Catalog No: AG007V2O MDL No:

Product Description

Catalog Number:
AG007V2O
Chemical Name:
2-Pentanone, 5-(2-benzothiazolylthio)-5-(trimethylsilyl)-
CAS Number:
106296-65-5
Molecular Formula:
C15H21NOS2Si
Molecular Weight:
323.5488
IUPAC Name:
5-(1,3-benzothiazol-2-ylsulfanyl)-5-trimethylsilylpentan-2-one
InChI:
InChI=1S/C15H21NOS2Si/c1-11(17)9-10-14(20(2,3)4)19-15-16-12-7-5-6-8-13(12)18-15/h5-8,14H,9-10H2,1-4H3
InChI Key:
KCRFCMVLDPBOIJ-UHFFFAOYSA-N
SMILES:
CC(=O)CCC([Si](C)(C)C)Sc1nc2c(s1)cccc2

Properties

Complexity:
345  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
323.083g/mol
Formal Charge:
0
Heavy Atom Count:
20  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
323.544g/mol
Monoisotopic Mass:
323.083g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
83.5A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0

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