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175202-71-8 | Benzo[c]thiophen-4(5H)-one, 6,7-dihydro-6,6-dimethyl-3-(methylthio)-, oxime
CAS No: 175202-71-8 Catalog No: AG0020I5 MDL No:
Product Description
Catalog Number:
AG0020I5
Chemical Name:
Benzo[c]thiophen-4(5H)-one, 6,7-dihydro-6,6-dimethyl-3-(methylthio)-, oxime
CAS Number:
175202-71-8
Molecular Formula:
C11H15NOS2
Molecular Weight:
241.3729
IUPAC Name:
N-(6,6-dimethyl-3-methylsulfanyl-5,7-dihydro-2-benzothiophen-4-ylidene)hydroxylamine
InChI:
InChI=1S/C11H15NOS2/c1-11(2)4-7-6-15-10(14-3)9(7)8(5-11)12-13/h6,13H,4-5H2,1-3H3
InChI Key:
MSRIAXHKDICKTA-UHFFFAOYSA-N
SMILES:
ON=C1CC(C)(C)Cc2c1c(SC)sc2
Properties
Complexity:
278
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
241.06g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
241.367g/mol
Monoisotopic Mass:
241.06g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
86.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
3.6
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