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2227205-66-3

2227205-66-3 | 5,5-difluoro-2-azabicyclo[2.2.2]octane hydrochloride

CAS No: 2227205-66-3 Catalog No: AG01FKDR MDL No:

Product Description

Catalog Number:
AG01FKDR
Chemical Name:
5,5-difluoro-2-azabicyclo[2.2.2]octane hydrochloride
CAS Number:
2227205-66-3
Molecular Formula:
C7H12ClF2N
Molecular Weight:
183.6267
IUPAC Name:
5,5-difluoro-2-azabicyclo[2.2.2]octane;hydrochloride
InChI:
InChI=1S/C7H11F2N.ClH/c8-7(9)3-6-2-1-5(7)4-10-6;/h5-6,10H,1-4H2;1H
InChI Key:
PTNQNXQQIINRDD-UHFFFAOYSA-N
SMILES:
FC1(F)CC2CCC1CN2.Cl

Properties

Complexity:
147  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
183.063g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
183.627g/mol
Monoisotopic Mass:
183.063g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
12A^2
Undefined Atom Stereocenter Count:
2  
Undefined Bond Stereocenter Count:
0

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