Carbamic acid, [(3S)-hexahydro-2-oxo-1H-azepin-3-yl]-,1,1-dimethylethyl ester


Chemical Name: Carbamic acid, [(3S)-hexahydro-2-oxo-1H-azepin-3-yl]-,1,1-dimethylethyl ester
CAS Number: 76944-95-1
Product Number: AG003R6D(AGN-PC-0UAROA)
Synonyms:
MDL No:
Molecular Formula: C11H20N2O3
Molecular Weight: 228.2881

Identification/Properties


Properties
BP:
417.7°C at 760 mmHg
Storage:
Keep in dry area;2-8℃;
Form:
Solid
Computed Properties
Molecular Weight:
228.292g/mol
XLogP3:
1.2
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
3
Exact Mass:
228.147g/mol
Monoisotopic Mass:
228.147g/mol
Topological Polar Surface Area:
67.4A^2
Heavy Atom Count:
16
Formal Charge:
0
Complexity:
271
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
1
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
Signal Word:
Warning
UN#:
N/A
Hazard Statements:
H315-H319-H335
Precautionary Statements:
P271-P280-P304+P340+P312-P405-P305+P351+P338-P403+P233-P501-P332+P313-P302+P352-P261-P264
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


Request for Quotation


Customer Feedback