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1824025-40-2 | 2,6-Dichlorophenyl 3,3,3-trifluoropropyl sulfide
CAS No: 1824025-40-2 Catalog No: AG01F9MF MDL No:MFCD28126792
Product Description
Catalog Number:
AG01F9MF
Chemical Name:
2,6-Dichlorophenyl 3,3,3-trifluoropropyl sulfide
CAS Number:
1824025-40-2
Molecular Formula:
C9H7Cl2F3S
Molecular Weight:
275.1181
MDL Number:
MFCD28126792
IUPAC Name:
1,3-dichloro-2-(3,3,3-trifluoropropylsulfanyl)benzene
InChI:
InChI=1S/C9H7Cl2F3S/c10-6-2-1-3-7(11)8(6)15-5-4-9(12,13)14/h1-3H,4-5H2
InChI Key:
ZRDFJDGXHURRHW-UHFFFAOYSA-N
SMILES:
FC(CCSc1c(Cl)cccc1Cl)(F)F
Properties
Complexity:
188
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
273.96g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
275.11g/mol
Monoisotopic Mass:
273.96g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
25.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.2
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