Home Carboxys 1-tert-Butyl 3-ethyl 4-oxoazepane-1,3-dicarboxylate

1-tert-Butyl 3-ethyl 4-oxoazepane-1,3-dicarboxylate

CAS No.:
98977-37-8
Catalog Number:
AG00IK76
Molecular Formula:
C14H23NO5
Molecular Weight:
285.3361
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
95%
1 week
United States
$385
- +
1g
95%
1 week
United States
$469
- +
Product Description
Catalog Number:
AG00IK76
Chemical Name:
1-tert-Butyl 3-ethyl 4-oxoazepane-1,3-dicarboxylate
CAS Number:
98977-37-8
Molecular Formula:
C14H23NO5
Molecular Weight:
285.3361
MDL Number:
MFCD08437284
IUPAC Name:
1-O-tert-butyl 3-O-ethyl 4-oxoazepane-1,3-dicarboxylate
InChI:
InChI=1S/C14H23NO5/c1-5-19-12(17)10-9-15(8-6-7-11(10)16)13(18)20-14(2,3)4/h10H,5-9H2,1-4H3
InChI Key:
JHXZHJRQFDJAPP-UHFFFAOYSA-N
SMILES:
CCOC(=O)C1CN(CCCC1=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