1H-Azepine-1-carboxylic acid, 4-aminohexahydro-, 1,1-dimethylethylester


Chemical Name: 1H-Azepine-1-carboxylic acid, 4-aminohexahydro-, 1,1-dimethylethylester
CAS Number: 196613-57-7
Product Number: AG0037VR(AGN-PC-0QOGKG)
Synonyms:
MDL No:
Molecular Formula: C11H22N2O2
Molecular Weight: 214.3046

Identification/Properties


Computed Properties
Molecular Weight:
214.309g/mol
XLogP3:
1.1
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
2
Exact Mass:
214.168g/mol
Monoisotopic Mass:
214.168g/mol
Topological Polar Surface Area:
55.6A^2
Heavy Atom Count:
15
Formal Charge:
0
Complexity:
223
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


NMR Spectrum


PNMR/1-Boc-hexahydro-1H-azepin-4-amine-196613-57-7-hnmr.pdf

Other Analytical Data


Request for Quotation


Customer Feedback