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2393-97-7

2393-97-7 | Bis((4-chlorophenyl);thio);methane

CAS No: 2393-97-7 Catalog No: AG003O9G MDL No:MFCD00041407

Product Description

Catalog Number:
AG003O9G
Chemical Name:
Bis((4-chlorophenyl);thio);methane
CAS Number:
2393-97-7
Molecular Formula:
C13H10Cl2S2
Molecular Weight:
301.2545
MDL Number:
MFCD00041407
IUPAC Name:
1-chloro-4-[(4-chlorophenyl)sulfanylmethylsulfanyl]benzene
InChI:
InChI=1S/C13H10Cl2S2/c14-10-1-5-12(6-2-10)16-9-17-13-7-3-11(15)4-8-13/h1-8H,9H2
InChI Key:
NTZBITFHYUVXFR-UHFFFAOYSA-N
SMILES:
Clc1ccc(cc1)SCSc1ccc(cc1)Cl
NSC Number:
89476

Properties

Complexity:
188  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
299.96g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
301.243g/mol
Monoisotopic Mass:
299.96g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
50.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
6  

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