Home Carboxys ethyl 2-azabicyclo[2.1.1]hexane-1-carboxylate hydrochloride

ethyl 2-azabicyclo[2.1.1]hexane-1-carboxylate hydrochloride

CAS No.:
1989671-42-2
Catalog Number:
AG01B6U9
Molecular Formula:
C8H14ClNO2
Molecular Weight:
191.6553
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Product Description
Catalog Number:
AG01B6U9
Chemical Name:
ethyl 2-azabicyclo[2.1.1]hexane-1-carboxylate hydrochloride
CAS Number:
1989671-42-2
Molecular Formula:
C8H14ClNO2
Molecular Weight:
191.6553
MDL Number:
MFCD30342948
IUPAC Name:
ethyl 2-azabicyclo[2.1.1]hexane-1-carboxylate;hydrochloride
InChI:
InChI=1S/C8H13NO2.ClH/c1-2-11-7(10)8-3-6(4-8)5-9-8;/h6,9H,2-5H2,1H3;1H
InChI Key:
ZMXSRWMKIWNDEA-UHFFFAOYSA-N
SMILES:
CCOC(=O)C12NCC(C1)C2.Cl
Properties
Complexity:
185  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
191.071g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
191.655g/mol
Monoisotopic Mass:
191.071g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
38.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties