161949-50-4,MFCD00672968
Catalog No.:AA001SGH

161949-50-4 | 2-Chloro-5-iodoanisole

Pack Size
Purity
Availability
Price(USD)
Quantity
  
100mg
98%
in stock  
$22.00   $16.00
- +
250mg
98%
in stock  
$26.00   $19.00
- +
1g
98%
in stock  
$50.00   $35.00
- +
5g
98%
in stock  
$248.00   $174.00
- +
  • Technical Information
  • Properties
  • Upstream Synthesis Route
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA001SGH
Chemical Name:
2-Chloro-5-iodoanisole
CAS Number:
161949-50-4
Molecular Formula:
C7H6ClIO
Molecular Weight:
268.4794
MDL Number:
MFCD00672968
SMILES:
COc1cc(I)ccc1Cl
Properties
Computed Properties
 
Complexity:
110  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0  
Defined Bond Stereocenter Count:
0  
Formal Charge:
0  
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0  
Isotope Atom Count:
0  
Rotatable Bond Count:
1  
Undefined Atom Stereocenter Count:
0  
Undefined Bond Stereocenter Count:
0  
XLogP3:
3.2  

Upstream Synthesis Route

[1]Patent:US5783522,1998,A,

[1]Patent:EP1386913,2004,A1,.Locationinpatent:Page70

[1]ChemicalCommunications,2006,#4,p.423-425

Downstream Synthesis Route

[1]ChemicalCommunications,2006,p.423-425

[1]ChemicalCommunications,2006,p.423-425

161949-50-4    755027-16-8   
3-(4-chloro-3-methoxyphenyl)-5,10-dihydro-11H-dibenzob,e1,4diazepin-11-one 

[1]JournalofMedicinalChemistry,2007,vol.50,p.4162-4176

[1]Patent:EP1386913,2004,A1.Locationinpatent:Page70

[1]Patent:US5783522,1998,A

Literature
Quotation Request
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Additional Info:
SDS
Tags:161949-50-4 Molecular Formula|161949-50-4 MDL|161949-50-4 SMILES|161949-50-4 2-Chloro-5-iodoanisole
Catalog No.: AA001SGH
161949-50-4,MFCD00672968
161949-50-4 | 2-Chloro-5-iodoanisole
Pack Size: 100mg
Purity: 98%
in stock
$22.00 $16.00
Pack Size: 250mg
Purity: 98%
in stock
$26.00 $19.00
Pack Size: 1g
Purity: 98%
in stock
$50.00 $35.00
Pack Size: 5g
Purity: 98%
in stock
$248.00 $174.00
Quantity
- +
Add to Card
Order Now
bulk Quotation Request
Technical Information
Catalog Number: AA001SGH
Chemical Name: 2-Chloro-5-iodoanisole
CAS Number: 161949-50-4
Molecular Formula: C7H6ClIO
Molecular Weight: 268.4794
MDL Number: MFCD00672968
SMILES: COc1cc(I)ccc1Cl
Properties
Complexity: 110  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 0  
Defined Bond Stereocenter Count: 0  
Formal Charge: 0  
Heavy Atom Count: 10  
Hydrogen Bond Acceptor Count: 1  
Hydrogen Bond Donor Count: 0  
Isotope Atom Count: 0  
Rotatable Bond Count: 1  
Undefined Atom Stereocenter Count: 0  
Undefined Bond Stereocenter Count: 0  
XLogP3: 3.2  
Upstream Synthesis Route
161949-50-4    121-43-7    89694-47-3 

[1]Patent:US5783522,1998,A,

161949-50-4    289039-26-5 

[1]Patent:EP1386913,2004,A1,.Locationinpatent:Page70

13726-14-2    161949-50-4 

[1]ChemicalCommunications,2006,#4,p.423-425

Downstream Synthesis Route
161949-50-4    18292-02-9    163041-47-2    65105-52-4 

[1]ChemicalCommunications,2006,p.423-425

13726-14-2    161949-50-4 

[1]ChemicalCommunications,2006,p.423-425

161949-50-4    755027-16-8   
3-(4-chloro-3-methoxyphenyl)-5,10-dihydro-11H-dibenzob,e1,4diazepin-11-one 

[1]JournalofMedicinalChemistry,2007,vol.50,p.4162-4176

161949-50-4    289039-26-5 

[1]Patent:EP1386913,2004,A1.Locationinpatent:Page70

161949-50-4    121-43-7    89694-47-3 

[1]Patent:US5783522,1998,A

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