Home Aminos Boc-4-aminohexahydro-4h-azepine

Boc-4-aminohexahydro-4h-azepine

CAS No.:
454451-28-6
Catalog Number:
AG0034HC
Molecular Formula:
C11H22N2O2
Molecular Weight:
214.3046
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$448
- +
5g
95%
In Stock USA
United States
$1462
- +
Product Description
Catalog Number:
AG0034HC
Chemical Name:
Boc-4-aminohexahydro-4h-azepine
CAS Number:
454451-28-6
Molecular Formula:
C11H22N2O2
Molecular Weight:
214.3046
MDL Number:
MFCD04038552
IUPAC Name:
tert-butyl N-(azepan-4-yl)carbamate
InChI:
InChI=1S/C11H22N2O2/c1-11(2,3)15-10(14)13-9-5-4-7-12-8-6-9/h9,12H,4-8H2,1-3H3,(H,13,14)
InChI Key:
MIYUNZAWHSSBPU-UHFFFAOYSA-N
SMILES:
O=C(OC(C)(C)C)NC1CCNCCC1
Properties
Complexity:
211  
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:
2  
Isotope Atom Count:
0
Molecular Weight:
214.309g/mol
Monoisotopic Mass:
214.168g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
50.4A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4  
Properties