tert-butyl 4-hydroxyazepane-1-carboxylate


Chemical Name: tert-butyl 4-hydroxyazepane-1-carboxylate
CAS Number: 478832-21-2
Product Number: AG006YNY(AGN-PC-03WXFT)
Synonyms:
MDL No: MFCD07368610
Molecular Formula: C11H21NO3
Molecular Weight: 215.2893

Identification/Properties


Computed Properties
Molecular Weight:
215.293g/mol
XLogP3:
1.3
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
2
Exact Mass:
215.152g/mol
Monoisotopic Mass:
215.152g/mol
Topological Polar Surface Area:
49.8A^2
Heavy Atom Count:
15
Formal Charge:
0
Complexity:
222
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


GHS Pictogram:
Signal Word:
Warning
UN#:
N/A
Hazard Statements:
H302-H315-H319-H332-H335
Precautionary Statements:
P261-P280-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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