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68121-46-0,MFCD00870149
Catalog No.:AA003IJF
68121-46-0 | 3,5-Dichlorothioanisole
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Purity
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Price(USD)
Quantity
  
5g
>98.0%(GC)
1 week  
$53.00   $37.00
- +
25g
>98.0%(GC)
1 week  
$159.00   $111.00
- +
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Technical Information
Catalog Number:
AA003IJF
Chemical Name:
3,5-Dichlorothioanisole
CAS Number:
68121-46-0
Molecular Formula:
C7H6Cl2S
Molecular Weight:
193.0935
MDL Number:
MFCD00870149
IUPAC Name:
1,3-dichloro-5-methylsulfanylbenzene
InChI:
InChI=1S/C7H6Cl2S/c1-10-7-3-5(8)2-6(9)4-7/h2-4H,1H3
InChI Key:
PSSCMQMQOXVMFG-UHFFFAOYSA-N
SMILES:
CSc1cc(Cl)cc(c1)Cl
Properties
Computed Properties
 
Complexity:
97.8  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
191.957g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
193.085g/mol
Monoisotopic Mass:
191.957g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
25.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7  

Synonyms
 
3,5-dichlorophenyl methyl sulfide 
DCPMT 
DCPMT 
PubChem10647 
ACMC-1BAWA 
AC1L2VBI 
AC1Q3MPS 
3,5-dichloro-thioanisole 
KSC356A6D 
SCHEMBL1713075 
3,5-Dichlorothioanisole, 97% 
CTK2F6061 
3,5-Dichlorothioanisole 
DTXSID50218310 
1,5-dichloro-3-methylthiobenzene 
1-methylthio-3,5-dichlorobenzene 
PSSCMQMQOXVMFG-UHFFFAOYSA-N 
ZINC404113 
Methyl(3,5-dichlorophenyl) sulfide 
ZX-AT009231 
ANW-35447 
MFCD00870149 
OR4653 
68121-46-0 
1,3-dichloro-5-methylsulfanylbenzene 
(3,5-dichlorophenyl)(methyl) sulfane 
AKOS006222086 
AS04290 
FCH2088790 
MCULE-7737201011 
RP25221 
RTR-022798 
TRA0070255 
VZ25748 
(3,5-dichlorophenyl)(methyl)sulfane 
1,3-dichloro-5-(methylsulfanyl)benzene 
AN-38210 
CC-13519 
CJ-03957 
L443 
ZB013385 
AB0014708 
DB-022045 
TR-022798 
D3520 
3,5-Dichlorophenyl methyl sulfide 
FT-0614528 
ST51041995 
KS-00001137 
Q-8401 
C-08518 
J-511310 
C7H6Cl2S 
C7-H6-Cl2-S 
Ditetradecyldimethylammonium bromide 
AR-1E9622 
3,5-Dichloro thioanisole 
CID129278 
68928-60-9 
Benzene, 1,3-dichloro-5-(methylthio)- 
1,3-Dichloro-5-(methylthio)benzene 
1,3-DICHLORO-5-METHYLSULFANYL-BENZENE 
Literature
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