Home Carboxys 3-Amino-azepane-1-carboxylic acid tert-butyl ester

3-Amino-azepane-1-carboxylic acid tert-butyl ester

CAS No.:
609789-17-5
Catalog Number:
AG003ITQ
Molecular Formula:
C11H22N2O2
Molecular Weight:
214.3046
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$520
- +
5g
95%
In Stock USA
United States
$1560
- +
Product Description
Catalog Number:
AG003ITQ
Chemical Name:
3-Amino-azepane-1-carboxylic acid tert-butyl ester
CAS Number:
609789-17-5
Molecular Formula:
C11H22N2O2
Molecular Weight:
214.3046
MDL Number:
MFCD06738754
IUPAC Name:
tert-butyl 3-aminoazepane-1-carboxylate
InChI:
InChI=1S/C11H22N2O2/c1-11(2,3)15-10(14)13-7-5-4-6-9(12)8-13/h9H,4-8,12H2,1-3H3
InChI Key:
WXWILWLHHQGUCX-UHFFFAOYSA-N
SMILES:
NC1CCCCN(C1)C(=O)OC(C)(C)C
Properties
Complexity:
223  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
214.168g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
214.309g/mol
Monoisotopic Mass:
214.168g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
55.6A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1  
Properties