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Home Carboxys Ethyl 1-Boc-5-oxo-hexahydro-1H-azepine-4-carboxylate

Ethyl 1-Boc-5-oxo-hexahydro-1H-azepine-4-carboxylate

CAS No.:
141642-82-2
Catalog Number:
AG001GRU
Molecular Formula:
C14H23NO5
Molecular Weight:
285.3361
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$119
- +
5g
95%
In Stock USA
United States
$369
- +
10g
95%
In Stock USA
United States
$619
- +
25g
95%
In Stock USA
United States
$1175
- +
Product Description
Catalog Number:
AG001GRU
Chemical Name:
Ethyl 1-Boc-5-oxo-hexahydro-1H-azepine-4-carboxylate
CAS Number:
141642-82-2
Molecular Formula:
C14H23NO5
Molecular Weight:
285.3361
MDL Number:
MFCD03788451
IUPAC Name:
1-O-tert-butyl 4-O-ethyl 5-oxoazepane-1,4-dicarboxylate
InChI:
InChI=1S/C14H23NO5/c1-5-19-12(17)10-6-8-15(9-7-11(10)16)13(18)20-14(2,3)4/h10H,5-9H2,1-4H3
InChI Key:
FGOJCPKOOGIRPA-UHFFFAOYSA-N
SMILES:
CCOC(=O)C1CCN(CCC1=O)C(=O)OC(C)(C)C
Properties
Complexity:
386  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
285.158g/mol
Formal Charge:
0
Heavy Atom Count:
20  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
285.34g/mol
Monoisotopic Mass:
285.158g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
72.9A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4  
Properties