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7782-37-8,MFCD00004254
Catalog No.:AA0057CY

7782-37-8 | Benzeneacetic acid, a-(1-methylpropyl)-

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
95%
in stock  
$72.00   $50.00
- +
5g
95%
in stock  
$186.00   $130.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA0057CY
Chemical Name:
Benzeneacetic acid, a-(1-methylpropyl)-
CAS Number:
7782-37-8
Molecular Formula:
C12H16O2
Molecular Weight:
192.2542
MDL Number:
MFCD00004254
SMILES:
CCC(C(c1ccccc1)C(=O)O)C
NSC Number:
165627
Properties
Properties
 
Form:
Solid  
MP:
50-52 °C(lit.)  

Computed Properties
 
Complexity:
183  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
4  
Undefined Atom Stereocenter Count:
2  
XLogP3:
3.3  

Downstream Synthesis Route

[1]CurrentPatentAssignee:SOLVAY-DE961170,1955,C

7782-37-8    100643-71-8   
1-4-(8-Chloro-5,6-dihydro-benzo5,6cyclohepta1,2-bpyridin-11-ylidene)-piperidin-1-yl-3-methyl-2-phenyl-pentan-1-one 

[1]Njoroge,F.George;Doll,RonaldJ.;Vibulbhan,Bancha;Alvarez,CarmenS.;Bishop,W.Robert;Petrin,Joanne;Kirschmeier,Paul;Carruthers,NicholasI.;Wong,JesseK.;Albanese,MargaretM.;Piwinski,JohnJ.;Catino,Joseph;Girijavallabhan;Ganguly,AshitK.[BioorganicandMedicinalChemistry,1997,vol.5,#1,p.101-113]

7782-37-8    726188-52-9   
C30H42IN3O 

[1]CurrentPatentAssignee:MERCK&COINC-US6391865,2002,B1Locationinpatent:Pagecolumn82

191337-05-0    7782-37-8   
N-{4-((7-chloroquinolin-4-yl)amino)cyclohexyl}-3-methyl-2-phenylpentanamide 

[1]CurrentPatentAssignee:ABBVIEINC-US2003/229119,2003,A1Locationinpatent:Page60

Literature
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SDS
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Tags:7782-37-8 Molecular Formula|7782-37-8 MDL|7782-37-8 SMILES|7782-37-8 Benzeneacetic acid, a-(1-methylpropyl)-
Catalog No.: AA0057CY
7782-37-8,MFCD00004254
7782-37-8 | Benzeneacetic acid, a-(1-methylpropyl)-
Pack Size： 1g
Purity： 95%
in stock
$72.00 $50.00
Pack Size： 5g
Purity： 95%
in stock
$186.00 $130.00
Quantity
- +
Add to Card
Order Now
bulk Quotation Request
Technical Information
Catalog Number: AA0057CY
Chemical Name: Benzeneacetic acid, a-(1-methylpropyl)-
CAS Number: 7782-37-8
Molecular Formula: C12H16O2
Molecular Weight: 192.2542
MDL Number: MFCD00004254
SMILES: CCC(C(c1ccccc1)C(=O)O)C
NSC Number: 165627
Properties
Form: Solid  
MP: 50-52 °C(lit.)  
Complexity: 183  
Covalently-Bonded Unit Count: 1  
Heavy Atom Count: 14  
Hydrogen Bond Acceptor Count: 2  
Hydrogen Bond Donor Count: 1  
Rotatable Bond Count: 4  
Undefined Atom Stereocenter Count: 2  
XLogP3: 3.3  
Downstream Synthesis Route
5558-32-7    7782-37-8 

[1]CurrentPatentAssignee:SOLVAY-DE961170,1955,C

7782-37-8    100643-71-8   
1-4-(8-Chloro-5,6-dihydro-benzo5,6cyclohepta1,2-bpyridin-11-ylidene)-piperidin-1-yl-3-methyl-2-phenyl-pentan-1-one 

[1]Njoroge,F.George;Doll,RonaldJ.;Vibulbhan,Bancha;Alvarez,CarmenS.;Bishop,W.Robert;Petrin,Joanne;Kirschmeier,Paul;Carruthers,NicholasI.;Wong,JesseK.;Albanese,MargaretM.;Piwinski,JohnJ.;Catino,Joseph;Girijavallabhan;Ganguly,AshitK.[BioorganicandMedicinalChemistry,1997,vol.5,#1,p.101-113]

7782-37-8    726188-52-9   
C30H42IN3O 

[1]CurrentPatentAssignee:MERCK&COINC-US6391865,2002,B1Locationinpatent:Pagecolumn82

191337-05-0    7782-37-8   
N-{4-((7-chloroquinolin-4-yl)amino)cyclohexyl}-3-methyl-2-phenylpentanamide 

[1]CurrentPatentAssignee:ABBVIEINC-US2003/229119,2003,A1Locationinpatent:Page60

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