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66073-49-2

66073-49-2 | 1-Azabicyclo[2.2.2]octane-2-carbonyl chloride, hydrochloride

CAS No: 66073-49-2 Catalog No: AG006KGR MDL No:

Product Description

Catalog Number:
AG006KGR
Chemical Name:
1-Azabicyclo[2.2.2]octane-2-carbonyl chloride, hydrochloride
CAS Number:
66073-49-2
Molecular Formula:
C8H13Cl2NO
Molecular Weight:
210.1009
IUPAC Name:
1-azabicyclo[2.2.2]octane-2-carbonyl chloride;hydrochloride
InChI:
InChI=1S/C8H12ClNO.ClH/c9-8(11)7-5-6-1-3-10(7)4-2-6;/h6-7H,1-5H2;1H
InChI Key:
OEIIDLJWURHUJC-UHFFFAOYSA-N
SMILES:
ClC(=O)C1CC2CCN1CC2.Cl

Properties

Complexity:
175  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
209.037g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
210.098g/mol
Monoisotopic Mass:
209.037g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
20.3A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0

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