Home Other Building Blocks 4,4,5,5,6,6,7,7-octafluoro-octahydro-1H-isoindole hydrochloride

4,4,5,5,6,6,7,7-octafluoro-octahydro-1H-isoindole hydrochloride

CAS No.:
2126161-73-5
Catalog Number:
AG01EHWZ
Molecular Formula:
C8H8ClF8N
Molecular Weight:
305.5960
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Product Description
Catalog Number:
AG01EHWZ
Chemical Name:
4,4,5,5,6,6,7,7-octafluoro-octahydro-1H-isoindole hydrochloride
CAS Number:
2126161-73-5
Molecular Formula:
C8H8ClF8N
Molecular Weight:
305.5960
MDL Number:
MFCD31381448
IUPAC Name:
4,4,5,5,6,6,7,7-octafluoro-2,3,3a,7a-tetrahydro-1H-isoindole;hydrochloride
InChI:
InChI=1S/C8H7F8N.ClH/c9-5(10)3-1-17-2-4(3)6(11,12)8(15,16)7(5,13)14;/h3-4,17H,1-2H2;1H
InChI Key:
FDVAWIXCTAXODR-UHFFFAOYSA-N
SMILES:
FC1(F)C2CNCC2C(C(C1(F)F)(F)F)(F)F.Cl
Properties
Complexity:
306  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
305.022g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
9  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
305.596g/mol
Monoisotopic Mass:
305.022g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
12A^2
Undefined Atom Stereocenter Count:
2  
Undefined Bond Stereocenter Count:
0
Properties