Home Carboxes 1011479-75-6
1011479-75-6,MFCD20126212
Catalog No.:AA0003R9
1011479-75-6 | Diethyl 1-boc-azetidine-3-dicarboxylate
Pack Size
Purity
Availability
Price(USD)
Quantity
  
250mg
95%
in stock  
$172.00   $120.00
- +
1g
95%
in stock  
$429.00   $300.00
- +
5g
95%
in stock  
$1,286.00   $900.00
- +
25g
95%
in stock  
$4,286.00   $3,000.00
- +
100g
95%
in stock  
$12,858.00   $9,000.00
- +
  • Technical Information
  • Properties
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  • Q & A
  • Technical Information
  • Properties
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Technical Information
Catalog Number:
AA0003R9
Chemical Name:
Diethyl 1-boc-azetidine-3-dicarboxylate
CAS Number:
1011479-75-6
Molecular Formula:
C14H23NO6
Molecular Weight:
301.3355
MDL Number:
MFCD20126212
IUPAC Name:
1-O-tert-butyl 3-O,3-O'-diethyl azetidine-1,3,3-tricarboxylate
InChI:
InChI=1S/C14H23NO6/c1-6-19-10(16)14(11(17)20-7-2)8-15(9-14)12(18)21-13(3,4)5/h6-9H2,1-5H3
InChI Key:
FYUPJGXEWFMXHW-UHFFFAOYSA-N
SMILES:
CCOC(=O)C1(CN(C1)C(=O)OC(C)(C)C)C(=O)OCC
Properties
Computed Properties
 
Complexity:
400  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
301.153g/mol
Formal Charge:
0
Heavy Atom Count:
21  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
301.339g/mol
Monoisotopic Mass:
301.153g/mol
Rotatable Bond Count:
8  
Topological Polar Surface Area:
82.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4  

Synonyms
 
1011479-75-6 
1-tert-butyl 3,3-diethyl azetidine-1,3,3-tricarboxylate 
KS-000003Y6 
AK170740 
AS-33791 
CS-0052386 
C-8702 
O1-tert-Butyl O3,O3'-diethyl azetidine-1,3,3-tricarboxylate 
Azetidine-1,3,3-tricarboxylic acid 1-tert-butyl ester 3,3-diethyl ester 
1,3,3-Azetidinetricarboxylic acid, 1-(1,1-dimethylethyl) 3,3-diethyl ester 
DIETHYL 1-BOC-AZETIDINE-3-DICARBOXYLATE 
SCHEMBL426525 
DTXSID20725581 
FYUPJGXEWFMXHW-UHFFFAOYSA-N 
MFCD20126212 
ZINC95627656 
AKOS025290844 
PB31966 
Literature
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