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175548-63-7 | Benzene, 1-[(2,5-dimethylphenyl)thio]-2,5-dimethyl-4-(methylthio)-
CAS No: 175548-63-7 Catalog No: AG002111 MDL No:
Product Description
Catalog Number:
AG002111
Chemical Name:
Benzene, 1-[(2,5-dimethylphenyl)thio]-2,5-dimethyl-4-(methylthio)-
CAS Number:
175548-63-7
Molecular Formula:
C17H20S2
Molecular Weight:
288.4707
IUPAC Name:
1-(2,5-dimethylphenyl)sulfanyl-2,5-dimethyl-4-methylsulfanylbenzene
InChI:
InChI=1S/C17H20S2/c1-11-6-7-12(2)16(8-11)19-17-10-13(3)15(18-5)9-14(17)4/h6-10H,1-5H3
InChI Key:
WFDZUYAJNGTMRW-UHFFFAOYSA-N
SMILES:
CSc1cc(C)c(cc1C)Sc1cc(C)ccc1C
Properties
Complexity:
278
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
288.101g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
288.467g/mol
Monoisotopic Mass:
288.101g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
50.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
6
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