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1253789-07-9,MFCD16295149
Catalog No.:AA009XCR

1253789-07-9 | 1-tert-butyl 3-Methyl 1,4-diazepane-1,3-dicarboxylate-HCl

Pack Size
Purity
Availability
Price(USD)
Quantity
  
250mg
≥95%
2 weeks  
$829.00   $580.00
- +
  • Technical Information
  • Properties
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA009XCR
Chemical Name:
1-tert-butyl 3-Methyl 1,4-diazepane-1,3-dicarboxylate-HCl
CAS Number:
1253789-07-9
Molecular Formula:
C12H22N2O4
Molecular Weight:
258.3141
MDL Number:
MFCD16295149
SMILES:
COC(=O)C1NCCCN(C1)C(=O)OC(C)(C)C
Properties
Computed Properties
 
Complexity:
312  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0  
Defined Bond Stereocenter Count:
0  
Formal Charge:
0  
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0  
Rotatable Bond Count:
4  
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0  
XLogP3:
0.8  

Literature
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SDS
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Tags:1253789-07-9 Molecular Formula|1253789-07-9 MDL|1253789-07-9 SMILES|1253789-07-9 1-tert-butyl 3-Methyl 1,4-diazepane-1,3-dicarboxylate-HCl
Catalog No.: AA009XCR
1253789-07-9,MFCD16295149
1253789-07-9 | 1-tert-butyl 3-Methyl 1,4-diazepane-1,3-dicarboxylate-HCl
Pack Size： 250mg
Purity： ≥95%
2 weeks
$829.00 $580.00
Quantity
- +
Add to Card
Order Now
bulk Quotation Request
Technical Information
Catalog Number: AA009XCR
Chemical Name: 1-tert-butyl 3-Methyl 1,4-diazepane-1,3-dicarboxylate-HCl
CAS Number: 1253789-07-9
Molecular Formula: C12H22N2O4
Molecular Weight: 258.3141
MDL Number: MFCD16295149
SMILES: COC(=O)C1NCCCN(C1)C(=O)OC(C)(C)C
Properties
Complexity: 312  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 0  
Defined Bond Stereocenter Count: 0  
Formal Charge: 0  
Heavy Atom Count: 18  
Hydrogen Bond Acceptor Count: 5  
Hydrogen Bond Donor Count: 1  
Isotope Atom Count: 0  
Rotatable Bond Count: 4  
Undefined Atom Stereocenter Count: 1  
Undefined Bond Stereocenter Count: 0  
XLogP3: 0.8  
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