2106-49-2,MFCD00069417
Catalog No.:AA002KTF

2106-49-2 | 1-Chloro-2-fluoro-3-nitrobenzene

Pack Size
Purity
Availability
Price(USD)
Quantity
  
10g
98%
in stock  
$13.00   $9.00
- +
25g
98%
in stock  
$20.00   $14.00
- +
100g
98%
in stock  
$50.00   $35.00
- +
500g
98%
in stock  
$98.00   $68.00
- +
  • Technical Information
  • Properties
  • Upstream Synthesis Route
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA002KTF
Chemical Name:
1-Chloro-2-fluoro-3-nitrobenzene
CAS Number:
2106-49-2
Molecular Formula:
C6H3ClFNO2
Molecular Weight:
175.5449
MDL Number:
MFCD00069417
SMILES:
[O-][N+](=O)c1cccc(c1F)Cl
NSC Number:
190665
Properties
Properties
 
BP:
135 - 140 °C at 12 - 15 mmHg  
Form:
Liquid  
MP:
36-40  
Storage:
Inert atmosphere;Room Temperature;  

Computed Properties
 
Complexity:
161  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0  
Defined Bond Stereocenter Count:
0  
Formal Charge:
0  
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0  
Isotope Atom Count:
0  
Rotatable Bond Count:
0  
Undefined Atom Stereocenter Count:
0  
Undefined Bond Stereocenter Count:
0  
XLogP3:
2.5  

Upstream Synthesis Route

[1]Patent:CN102249881,2016,B,.Locationinpatent:Paragraph0015;0050-0051

[1]Patent:CN102249881,2016,B,

[1]Patent:CN102249881,2016,B,.Locationinpatent:Paragraph0015;0039-0040

[2]JournalofMedicinalChemistry,2001,vol.44,#10,p.1516-1529

[3]JournaloftheAmericanChemicalSociety,1959,vol.81,p.94,95,97

[4]Patent:US5476976,1995,A,

[5]Patent:US5545768,1996,A,

[1]Patent:US5476976,1995,A,

[1]Patent:US5476976,1995,A,

Downstream Synthesis Route

[1]Patent:CN102249881,2016,B.Locationinpatent:Paragraph0015;0039-0040

[2]JournalofMedicinalChemistry,2001,vol.44,p.1516-1529

[3]JournaloftheAmericanChemicalSociety,1959,vol.81,p.94,95,97

[4]Patent:US5476976,1995,A

[5]Patent:US5545768,1996,A

[6]OrganicProcessResearchandDevelopment,2021,vol.25,p.2338-2350

[1]JournaloftheAmericanChemicalSociety,1959,vol.81,p.94,95,97

2106-49-2    21887-64-9   
(S)-2-tert-Butoxycarbonylamino-5-(2-chloro-6-nitro-phenylamino)-pentanoicacid 

[1]JournalofMedicinalChemistry,1998,vol.41,p.2636-2642

[1]JournalofMedicinalChemistry,2001,vol.44,p.1516-1529

2106-49-2   
R(-)-2-amino-3-(7-chloro-1-phosphonomethyl-1H-benzoimidazol-2-yl)-propionicacid 

[1]JournalofMedicinalChemistry,2001,vol.44,p.1516-1529

Literature
Quotation Request
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Additional Info:
SDS
Tags:2106-49-2 Molecular Formula|2106-49-2 MDL|2106-49-2 SMILES|2106-49-2 1-Chloro-2-fluoro-3-nitrobenzene
Catalog No.: AA002KTF
2106-49-2,MFCD00069417
2106-49-2 | 1-Chloro-2-fluoro-3-nitrobenzene
Pack Size: 10g
Purity: 98%
in stock
$13.00 $9.00
Pack Size: 25g
Purity: 98%
in stock
$20.00 $14.00
Pack Size: 100g
Purity: 98%
in stock
$50.00 $35.00
Pack Size: 500g
Purity: 98%
in stock
$98.00 $68.00
Quantity
- +
Add to Card
Order Now
bulk Quotation Request
Technical Information
Catalog Number: AA002KTF
Chemical Name: 1-Chloro-2-fluoro-3-nitrobenzene
CAS Number: 2106-49-2
Molecular Formula: C6H3ClFNO2
Molecular Weight: 175.5449
MDL Number: MFCD00069417
SMILES: [O-][N+](=O)c1cccc(c1F)Cl
NSC Number: 190665
Properties
BP: 135 - 140 °C at 12 - 15 mmHg  
Form: Liquid  
MP: 36-40  
Storage: Inert atmosphere;Room Temperature;  
Complexity: 161  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 0  
Defined Bond Stereocenter Count: 0  
Formal Charge: 0  
Heavy Atom Count: 11  
Hydrogen Bond Acceptor Count: 3  
Hydrogen Bond Donor Count: 0  
Isotope Atom Count: 0  
Rotatable Bond Count: 0  
Undefined Atom Stereocenter Count: 0  
Undefined Bond Stereocenter Count: 0  
XLogP3: 2.5  
Upstream Synthesis Route
2106-49-2    2268-05-5 

[1]Patent:CN102249881,2016,B,.Locationinpatent:Paragraph0015;0050-0051

2106-49-2    771-69-7 

[1]Patent:CN102249881,2016,B,

3209-22-1    2106-49-2 

[1]Patent:CN102249881,2016,B,.Locationinpatent:Paragraph0015;0039-0040

[2]JournalofMedicinalChemistry,2001,vol.44,#10,p.1516-1529

[3]JournaloftheAmericanChemicalSociety,1959,vol.81,p.94,95,97

[4]Patent:US5476976,1995,A,

[5]Patent:US5545768,1996,A,

3209-22-1    2106-49-2 

[1]Patent:US5476976,1995,A,

3209-22-1    2106-49-2 

[1]Patent:US5476976,1995,A,

Downstream Synthesis Route
3209-22-1    2106-49-2 

[1]Patent:CN102249881,2016,B.Locationinpatent:Paragraph0015;0039-0040

[2]JournalofMedicinalChemistry,2001,vol.44,p.1516-1529

[3]JournaloftheAmericanChemicalSociety,1959,vol.81,p.94,95,97

[4]Patent:US5476976,1995,A

[5]Patent:US5545768,1996,A

[6]OrganicProcessResearchandDevelopment,2021,vol.25,p.2338-2350

2106-49-2    2106-04-9 

[1]JournaloftheAmericanChemicalSociety,1959,vol.81,p.94,95,97

2106-49-2    21887-64-9   
(S)-2-tert-Butoxycarbonylamino-5-(2-chloro-6-nitro-phenylamino)-pentanoicacid 

[1]JournalofMedicinalChemistry,1998,vol.41,p.2636-2642

2106-49-2    345203-24-9 

[1]JournalofMedicinalChemistry,2001,vol.44,p.1516-1529

2106-49-2   
R(-)-2-amino-3-(7-chloro-1-phosphonomethyl-1H-benzoimidazol-2-yl)-propionicacid 

[1]JournalofMedicinalChemistry,2001,vol.44,p.1516-1529

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