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3699-01-2 | 4-METHYLDIPHENYL SULFIDE
CAS No: 3699-01-2 Catalog No: AG003LRV MDL No:MFCD00092378
Product Description
Catalog Number:
AG003LRV
Chemical Name:
4-METHYLDIPHENYL SULFIDE
CAS Number:
3699-01-2
MDL Number:
MFCD00092378
IUPAC Name:
1-methyl-4-phenylsulfanylbenzene
InChI:
InChI=1S/C13H12S/c1-11-7-9-13(10-8-11)14-12-5-3-2-4-6-12/h2-10H,1H3
InChI Key:
CPZFPNKPHBCUOB-UHFFFAOYSA-N
Properties
Complexity:
153
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
200.066g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
200.299g/mol
Monoisotopic Mass:
200.066g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
25.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.8
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