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13831-03-3,MFCD00060100
Catalog No.:AA0018FZ

13831-03-3 | tert-Butyl propiolate

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
97%
in stock  
$18.00   $12.00
- +
5g
97%
in stock  
$40.00   $28.00
- +
10g
97%
in stock  
$76.00   $53.00
- +
25g
97%
in stock  
$160.00   $112.00
- +
  • Technical Information
  • Properties
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA0018FZ
Chemical Name:
tert-Butyl propiolate
CAS Number:
13831-03-3
Molecular Formula:
C7H10O2
Molecular Weight:
126.1531
MDL Number:
MFCD00060100
SMILES:
C#CC(=O)OC(C)(C)C
Properties
Properties
 
BP:
159.6°C at 760 mmHg  
Form:
Solid  
MP:
18-20 °C(lit.)  
Refractive Index:
n20/D 1.418(lit.)  
Stability:
Air Sensitive  
Storage:
Inert atmosphere;2-8℃;  

Computed Properties
 
Complexity:
154  
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:
2  
Hydrogen Bond Donor Count:
0  
Isotope Atom Count:
0  
Rotatable Bond Count:
2  
Undefined Atom Stereocenter Count:
0  
Undefined Bond Stereocenter Count:
0  
XLogP3:
1.6  

Literature

Title: Ring expansion of lactones and lactams via propiolate 1-carbon intercalation.

Journal: Organic letters 20080918

Title: Bocdene and mocdene derivatives of catechols and catecholamines.

Journal: Organic letters 20010503

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SDS
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Tags:13831-03-3 Molecular Formula|13831-03-3 MDL|13831-03-3 SMILES|13831-03-3 tert-Butyl propiolate
Catalog No.: AA0018FZ
13831-03-3,MFCD00060100
13831-03-3 | tert-Butyl propiolate
Pack Size： 1g
Purity： 97%
in stock
$18.00 $12.00
Pack Size： 5g
Purity： 97%
in stock
$40.00 $28.00
Pack Size： 10g
Purity： 97%
in stock
$76.00 $53.00
Pack Size： 25g
Purity： 97%
in stock
$160.00 $112.00
Quantity
- +
Add to Card
Order Now
bulk Quotation Request
Technical Information
Catalog Number: AA0018FZ
Chemical Name: tert-Butyl propiolate
CAS Number: 13831-03-3
Molecular Formula: C7H10O2
Molecular Weight: 126.1531
MDL Number: MFCD00060100
SMILES: C#CC(=O)OC(C)(C)C
Properties
BP: 159.6°C at 760 mmHg  
Form: Solid  
MP: 18-20 °C(lit.)  
Refractive Index: n20/D 1.418(lit.)  
Stability: Air Sensitive  
Storage: Inert atmosphere;2-8℃;  
Complexity: 154  
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: 2  
Hydrogen Bond Donor Count: 0  
Isotope Atom Count: 0  
Rotatable Bond Count: 2  
Undefined Atom Stereocenter Count: 0  
Undefined Bond Stereocenter Count: 0  
XLogP3: 1.6  
Literature fold

Title: Ring expansion of lactones and lactams via propiolate 1-carbon intercalation.

Journal: Organic letters20080918

Title: Bocdene and mocdene derivatives of catechols and catecholamines.

Journal: Organic letters20010503

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