Home Carboxys tert-Butyl 4-acetylazepane-1-carboxylate

tert-Butyl 4-acetylazepane-1-carboxylate

CAS No.:
1630906-71-6
Catalog Number:
AG001TPX
Molecular Formula:
C13H23NO3
Molecular Weight:
241.3266
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
100mg
97%
1 week
United States
$199
- +
250mg
97%
1 week
United States
$362
- +
1g
97%
1 week
United States
$846
- +
Product Description
Catalog Number:
AG001TPX
Chemical Name:
tert-Butyl 4-acetylazepane-1-carboxylate
CAS Number:
1630906-71-6
Molecular Formula:
C13H23NO3
Molecular Weight:
241.3266
MDL Number:
MFCD27986938
IUPAC Name:
tert-butyl 4-acetylazepane-1-carboxylate
InChI:
InChI=1S/C13H23NO3/c1-10(15)11-6-5-8-14(9-7-11)12(16)17-13(2,3)4/h11H,5-9H2,1-4H3
InChI Key:
ZYNLWRZPRVEDFH-UHFFFAOYSA-N
SMILES:
O=C(N1CCCC(CC1)C(=O)C)OC(C)(C)C
Properties
Complexity:
294  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
241.168g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
241.331g/mol
Monoisotopic Mass:
241.168g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
46.6A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6  
Properties