53102-14-0,MFCD11982991
Catalog No.:AA00DPTS

53102-14-0 | 3-Chloro-2-cyclopenten-1-one

Pack Size
Purity
Availability
Price(USD)
Quantity
  
100mg
95%
in stock  
$148.00   $104.00
- +
250mg
95%
in stock  
$250.00   $175.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA00DPTS
Chemical Name:
3-Chloro-2-cyclopenten-1-one
CAS Number:
53102-14-0
Molecular Formula:
C5H5ClO
Molecular Weight:
116.5456
MDL Number:
MFCD11982991
SMILES:
ClC1=CC(=O)CC1
Properties
Computed Properties
 
Complexity:
126  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0  
Defined Bond Stereocenter Count:
0  
Formal Charge:
0  
Heavy Atom Count:
7  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0  
Isotope Atom Count:
0  
Rotatable Bond Count:
0  
Undefined Atom Stereocenter Count:
0  
Undefined Bond Stereocenter Count:
0  
XLogP3:
0.9  

Downstream Synthesis Route

[1]Eckelbarger,JosephD.;Wilmot,JeremyT.;Epperson,MatthewT.;Thakur,ChandarS.;Shum,David;Antczak,Christophe;Tarassishin,Leonid;Djaballah,Hakim;Gin,DavidY.[Chemistry-AEuropeanJournal,2008,vol.14,#14,p.4293-4306]

[2]CurrentPatentAssignee:MEMORIALSLOAN-KETTERINGCANCERCENTER-WO2009/148654,2009,A2Locationinpatent:Page/Pagecolumn106-107

[3]Clark,R.D.;Heathcock,C.H.[JournalofOrganicChemistry,1976,vol.41,p.636-643]

[4]Tamura;Kato;Yoshimura;etal.[ChemicalandPharmaceuticalBulletin,1974,vol.22,#6,p.1291-1296]

[5]Ullrich,JohnW.;Chiu,Fang-Ting;Tiner-Harding,Tammy;Mariano,PatrickS.[JournalofOrganicChemistry,1984,vol.49,#2,p.220-228]

[1]Tetrahedron,2001,vol.57,p.7383-7390

Literature
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Additional Info:
SDS
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Tags:53102-14-0 Molecular Formula|53102-14-0 MDL|53102-14-0 SMILES|53102-14-0 3-Chloro-2-cyclopenten-1-one
Catalog No.: AA00DPTS
53102-14-0,MFCD11982991
53102-14-0 | 3-Chloro-2-cyclopenten-1-one
Pack Size: 100mg
Purity: 95%
in stock
$148.00 $104.00
Pack Size: 250mg
Purity: 95%
in stock
$250.00 $175.00
Quantity
- +
Add to Card
Order Now
bulk Quotation Request
Technical Information
Catalog Number: AA00DPTS
Chemical Name: 3-Chloro-2-cyclopenten-1-one
CAS Number: 53102-14-0
Molecular Formula: C5H5ClO
Molecular Weight: 116.5456
MDL Number: MFCD11982991
SMILES: ClC1=CC(=O)CC1
Properties
Complexity: 126  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 0  
Defined Bond Stereocenter Count: 0  
Formal Charge: 0  
Heavy Atom Count: 7  
Hydrogen Bond Acceptor Count: 1  
Hydrogen Bond Donor Count: 0  
Isotope Atom Count: 0  
Rotatable Bond Count: 0  
Undefined Atom Stereocenter Count: 0  
Undefined Bond Stereocenter Count: 0  
XLogP3: 0.9  
Downstream Synthesis Route
3859-41-4    53102-14-0 

[1]Eckelbarger,JosephD.;Wilmot,JeremyT.;Epperson,MatthewT.;Thakur,ChandarS.;Shum,David;Antczak,Christophe;Tarassishin,Leonid;Djaballah,Hakim;Gin,DavidY.[Chemistry-AEuropeanJournal,2008,vol.14,#14,p.4293-4306]

[2]CurrentPatentAssignee:MEMORIALSLOAN-KETTERINGCANCERCENTER-WO2009/148654,2009,A2Locationinpatent:Page/Pagecolumn106-107

[3]Clark,R.D.;Heathcock,C.H.[JournalofOrganicChemistry,1976,vol.41,p.636-643]

[4]Tamura;Kato;Yoshimura;etal.[ChemicalandPharmaceuticalBulletin,1974,vol.22,#6,p.1291-1296]

[5]Ullrich,JohnW.;Chiu,Fang-Ting;Tiner-Harding,Tammy;Mariano,PatrickS.[JournalofOrganicChemistry,1984,vol.49,#2,p.220-228]

53102-14-0    169126-64-1    250369-11-0 

[1]Tetrahedron,2001,vol.57,p.7383-7390

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