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88388-89-0 | Benzene, 1-chloro-4-[(1,1,2,2-tetrachloroethyl)thio]-
CAS No: 88388-89-0 Catalog No: AG004ILH MDL No:
Product Description
Catalog Number:
AG004ILH
Chemical Name:
Benzene, 1-chloro-4-[(1,1,2,2-tetrachloroethyl)thio]-
CAS Number:
88388-89-0
Molecular Formula:
C8H5Cl5S
Molecular Weight:
310.4553
IUPAC Name:
1-chloro-4-(1,1,2,2-tetrachloroethylsulfanyl)benzene
InChI:
InChI=1S/C8H5Cl5S/c9-5-1-3-6(4-2-5)14-8(12,13)7(10)11/h1-4,7H
InChI Key:
BQJBDPXHYXWVEX-UHFFFAOYSA-N
SMILES:
Clc1ccc(cc1)SC(C(Cl)Cl)(Cl)Cl
Properties
Complexity:
177
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
309.853g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
310.438g/mol
Monoisotopic Mass:
307.855g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
25.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.7
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