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Home > Other Heterocycles > 1374656-75-3

1374656-75-3

1374656-75-3 | 8-Azabicyclo[3.2.1]octane-3-carbonitrile, hydrochloride (1:1)

CAS No: 1374656-75-3 Catalog No: AG0013BN MDL No:

Product Description

Catalog Number:
AG0013BN
Chemical Name:
8-Azabicyclo[3.2.1]octane-3-carbonitrile, hydrochloride (1:1)
CAS Number:
1374656-75-3
Molecular Formula:
C8H13ClN2
Molecular Weight:
172.6552
IUPAC Name:
8-azabicyclo[3.2.1]octane-3-carbonitrile;hydrochloride
InChI:
InChI=1S/C8H12N2.ClH/c9-5-6-3-7-1-2-8(4-6)10-7;/h6-8,10H,1-4H2;1H
InChI Key:
KJBZNGALZBMOCJ-UHFFFAOYSA-N
SMILES:
N#CC1CC2CCC(C1)N2.Cl

Properties

Complexity:
167  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
172.077g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
172.656g/mol
Monoisotopic Mass:
172.077g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
35.8A^2
Undefined Atom Stereocenter Count:
2  
Undefined Bond Stereocenter Count:
0

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