1032231-28-9,MFCD15523585
Catalog No.:AA008YY7

1032231-28-9 | 5-Bromo-2-cyanobenzoic acid

Pack Size
Purity
Availability
Price(USD)
Quantity
  
250mg
95%
in stock  
$154.00   $108.00
- +
1g
95%
in stock  
$361.00   $253.00
- +
5g
95%
in stock  
$1,408.00 $986.00
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA008YY7
Chemical Name:
5-Bromo-2-cyanobenzoic acid
CAS Number:
1032231-28-9
Molecular Formula:
C8H4BrNO2
Molecular Weight:
226.0269
MDL Number:
MFCD15523585
SMILES:
N#Cc1ccc(cc1C(=O)O)Br
Properties
Computed Properties
 
Complexity:
233  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0  
Defined Bond Stereocenter Count:
0  
Formal Charge:
0  
Heavy Atom Count:
12  
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:
2.8  

Downstream Synthesis Route

[1]Locationinpatent:experimentalpartLulinski,Sergiusz;Serwatowski,Janusz;Szczerbinska,Magdalena[EuropeanJournalofOrganicChemistry,2008,#10,p.1797-1801]

[2]CurrentPatentAssignee:SHENZHENLANGRUNINVESTMENTCO.,LTD.-US2017/37038,2017,A1Locationinpatent:Paragraph0096;0118;0119;0120

1032231-28-9    74-89-5   
5-bromo-2-cyano-N-methylbenzamide 

[1]CurrentPatentAssignee:FIMBRIONTHERAPEUTICSINC-WO2017/156508,2017,A1Locationinpatent:Paragraph00400

[1]CurrentPatentAssignee:CRÉDITINDUSTRIELETCOMMERCIAL-CIC;BANQUEDEVIZILLE;SERVIERMONDE-WO2021/224320,2021,A1Locationinpatent:Page/Pagecolumn279-280

[2]CurrentPatentAssignee:CRÉDITINDUSTRIELETCOMMERCIAL-CIC;BANQUEDEVIZILLE;SERVIERMONDE-WO2021/224320,2021,A1Locationinpatent:Page/Pagecolumn279-280

Literature
Quotation Request
Company Name:
*
Contact Person:
*
Email:
*
Quantity Required:
*
Country:
Additional Info:
SDS
Related Products of 1032231-28-9
Tags:1032231-28-9 Molecular Formula|1032231-28-9 MDL|1032231-28-9 SMILES|1032231-28-9 5-Bromo-2-cyanobenzoic acid
Catalog No.: AA008YY7
1032231-28-9,MFCD15523585
1032231-28-9 | 5-Bromo-2-cyanobenzoic acid
Pack Size: 250mg
Purity: 95%
in stock
$154.00 $108.00
Pack Size: 1g
Purity: 95%
in stock
$361.00 $253.00
Pack Size: 5g
Purity: 95%
in stock
$1,408.00 $986.00
Quantity
- +
Add to Card
Order Now
bulk Quotation Request
Technical Information
Catalog Number: AA008YY7
Chemical Name: 5-Bromo-2-cyanobenzoic acid
CAS Number: 1032231-28-9
Molecular Formula: C8H4BrNO2
Molecular Weight: 226.0269
MDL Number: MFCD15523585
SMILES: N#Cc1ccc(cc1C(=O)O)Br
Properties
Complexity: 233  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 0  
Defined Bond Stereocenter Count: 0  
Formal Charge: 0  
Heavy Atom Count: 12  
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: 2.8  
Downstream Synthesis Route
124-38-9    623-00-7    1032231-28-9 

[1]Locationinpatent:experimentalpartLulinski,Sergiusz;Serwatowski,Janusz;Szczerbinska,Magdalena[EuropeanJournalofOrganicChemistry,2008,#10,p.1797-1801]

[2]CurrentPatentAssignee:SHENZHENLANGRUNINVESTMENTCO.,LTD.-US2017/37038,2017,A1Locationinpatent:Paragraph0096;0118;0119;0120

1032231-28-9    74-89-5   
5-bromo-2-cyano-N-methylbenzamide 

[1]CurrentPatentAssignee:FIMBRIONTHERAPEUTICSINC-WO2017/156508,2017,A1Locationinpatent:Paragraph00400

1032231-28-9    75-03-6    127510-93-4 

[1]CurrentPatentAssignee:CRÉDITINDUSTRIELETCOMMERCIAL-CIC;BANQUEDEVIZILLE;SERVIERMONDE-WO2021/224320,2021,A1Locationinpatent:Page/Pagecolumn279-280

[2]CurrentPatentAssignee:CRÉDITINDUSTRIELETCOMMERCIAL-CIC;BANQUEDEVIZILLE;SERVIERMONDE-WO2021/224320,2021,A1Locationinpatent:Page/Pagecolumn279-280

Building Blocks More >
1050619-81-2
1050619-81-2
5-Chloro-1-phenyl-1H-pyrazole-4-carbonitrile
AA008Z2T | MFCD09959879
106868-88-6
106868-88-6
3-(4-semicarbazido)propyltriethoxysilane
AA008ZML | MFCD09953890
1072944-89-8
1072944-89-8
5-Amino-1-(3-bromophenyl)-4-cyano-3-methylpyrazole
AA0090CL | MFCD11504941
1185075-85-7
1185075-85-7
[(3-isobutyl-1,2,4-oxadiazol-5-yl)methyl]methylamine hydrochloride
AA0090MW | MFCD12028452
1135-80-4
1135-80-4
1'H-Spiro[cyclopentane-1,2'-quinazolin]-4'(3'h)-one
AA0090V3 | MFCD00171145
1082658-92-1
1082658-92-1
1,2,3,4-Tetrahydroisoquinolin-5-amine hydrochloride
AA0090Z2 | MFCD08461265
1057279-05-6
1057279-05-6
2-(4-Bromophenyl)-1,2,3,4-tetrahydroisoquinoline
AA0091VQ | MFCD20919931
1063733-41-4
1063733-41-4
N-(2,4-Dimethoxybenzyl)-1,2,4-thiadiazol-5-amine
AA00926W | MFCD20784227
1123169-23-2
1123169-23-2
Methyl 6-bromobenzo[d]isoxazole-3-carboxylate
AA0092HY | MFCD11858439
1203579-53-6
1203579-53-6
3,7-Dibromo-4-hydroxyquinoline
AA00931T | MFCD13192872
Submit
© 2017 AA BLOCKS, INC. All rights reserved.