+1 858-523-8231
Login | Register
menu
AA Blocks, Building Blocks, Catalysts, Inhibitors
Login | Register
31491-45-9,MFCD18393139
Catalog No.:AA007J25

31491-45-9 | 2-Chlorofuran-3-carboxylic acid

Pack Size
Purity
Availability
Price(USD)
Quantity
  
100mg
95%
in stock  
$473.00   $331.00
- +
250mg
95%
in stock  
$895.00   $627.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA007J25
Chemical Name:
2-Chlorofuran-3-carboxylic acid
CAS Number:
31491-45-9
Molecular Formula:
C5H3ClO3
Molecular Weight:
146.5285
MDL Number:
MFCD18393139
SMILES:
OC(=O)c1ccoc1Cl
Properties
Computed Properties
 
Complexity:
125  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0  
Defined Bond Stereocenter Count:
0  
Formal Charge:
0  
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0  
Rotatable Bond Count:
1  
Undefined Atom Stereocenter Count:
0  
Undefined Bond Stereocenter Count:
0  
XLogP3:
1.5  

Downstream Synthesis Route

[1]Locationinpatent:experimentalpartSchnute,MarkE.;Brideau,RogerJ.;Collier,SarahA.;Cudahy,MicheleM.;Hopkins,ToddA.;Knechtel,MaryL.;Oien,NanceeL.;Sackett,RobertS.;Scott,Allen;Stephan,MariL.;Wathen,MichaelW.;Wieber,JanetL.[BioorganicandMedicinalChemistryLetters,2008,vol.18,#14,p.3856-3859]

[2]Pierre,Cathleen;Baudoin,Olivier[OrganicLetters,2011,vol.13,#7,p.1816-1819]

[3]CurrentPatentAssignee:NOVARTISAG;Novartis(w/oSandoz)-WO2017/184624,2017,A1Locationinpatent:Page/Pagecolumn179;180

[4]Kelemen,ÁdámAndor;Szabó,BalázsPéter;Kovács,Péter;Keseru,GyörgyMiklós[TetrahedronLetters,2016,vol.57,#1,p.64-66]

[5]CurrentPatentAssignee:DUPONTDENEMOURSINC-WO2017/116646,2017,A1Locationinpatent:Page/Pagecolumn25

Literature
Quotation Request
Company Name:
*
Contact Person:
*
Email:
*
Quantity Required:
*
Country:
Additional Info:
Submit
SDS
Related Products of 31491-45-9
Building Blocks
More >
Historical Records
853897-20-8

853897-20-8

 457650-71-4

457650-71-4
Tags:31491-45-9 Molecular Formula|31491-45-9 MDL|31491-45-9 SMILES|31491-45-9 2-Chlorofuran-3-carboxylic acid
Catalog No.: AA007J25
31491-45-9,MFCD18393139
31491-45-9 | 2-Chlorofuran-3-carboxylic acid
Pack Size： 100mg
Purity： 95%
in stock
$473.00 $331.00
Pack Size： 250mg
Purity： 95%
in stock
$895.00 $627.00
Quantity
- +
Add to Card
Order Now
bulk Quotation Request
Technical Information
Catalog Number: AA007J25
Chemical Name: 2-Chlorofuran-3-carboxylic acid
CAS Number: 31491-45-9
Molecular Formula: C5H3ClO3
Molecular Weight: 146.5285
MDL Number: MFCD18393139
SMILES: OC(=O)c1ccoc1Cl
Properties
Complexity: 125  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 0  
Defined Bond Stereocenter Count: 0  
Formal Charge: 0  
Heavy Atom Count: 9  
Hydrogen Bond Acceptor Count: 3  
Hydrogen Bond Donor Count: 1  
Isotope Atom Count: 0  
Rotatable Bond Count: 1  
Undefined Atom Stereocenter Count: 0  
Undefined Bond Stereocenter Count: 0  
XLogP3: 1.5  
Downstream Synthesis Route
488-93-7    31491-45-9 

[1]Locationinpatent:experimentalpartSchnute,MarkE.;Brideau,RogerJ.;Collier,SarahA.;Cudahy,MicheleM.;Hopkins,ToddA.;Knechtel,MaryL.;Oien,NanceeL.;Sackett,RobertS.;Scott,Allen;Stephan,MariL.;Wathen,MichaelW.;Wieber,JanetL.[BioorganicandMedicinalChemistryLetters,2008,vol.18,#14,p.3856-3859]

[2]Pierre,Cathleen;Baudoin,Olivier[OrganicLetters,2011,vol.13,#7,p.1816-1819]

[3]CurrentPatentAssignee:NOVARTISAG;Novartis(w/oSandoz)-WO2017/184624,2017,A1Locationinpatent:Page/Pagecolumn179;180

[4]Kelemen,ÁdámAndor;Szabó,BalázsPéter;Kovács,Péter;Keseru,GyörgyMiklós[TetrahedronLetters,2016,vol.57,#1,p.64-66]

[5]CurrentPatentAssignee:DUPONTDENEMOURSINC-WO2017/116646,2017,A1Locationinpatent:Page/Pagecolumn25

Related Products of of 31491-45-9
Building Blocks More >
152302-45-9
152302-45-9
N-(2-(7-Hydroxynaphthalen-1-yl)ethyl)acetamide
AA007JJ5 | MFCD20271735
147663-00-1
147663-00-1
Isochroman-4-amine
AA007K0J | MFCD08448171
267242-09-1
267242-09-1
4-Cyano-2-(trifluoromethyl)benzoic acid
AA007KOK | MFCD11977374
1355247-57-2
1355247-57-2
N,N-Dimethyl-4-(4-nitrophenyl)benzamide
AA007LAZ | MFCD21332995
27992-31-0
27992-31-0
5,6-Dimethylpyridin-2(1H)-one
AA007LRW | MFCD00859248
269398-82-5
269398-82-5
(R)-3-Amino-4-(3-methylphenyl)butanoic acid HCl
AA007M90 | MFCD01860924
26791-93-5
26791-93-5
Methyl 4,5-dimethoxy-2-nitrobenzoate
AA007MO6 | MFCD00007239
2538-98-9
2538-98-9
4-Isopropoxy-3-methoxy-benzaldehyde
AA007N8R | MFCD00837588
25260-36-0
25260-36-0
2-Chloro-1-(4-pyridinyl)ethanone, HCl
AA007NS8 | MFCD08692051
22529-61-9
22529-61-9
3-O-Benzyl-1,2-O-isopropylidene-α-D-glucofuranose
AA007O9K | MFCD02683275
Historical Records
853897-20-8
853897-20-8
457650-71-4
457650-71-4
Submit
© 2017 AA BLOCKS, INC. All rights reserved.