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Home > Other Heterocycles > 1909287-58-6
1909287-58-6 | rac-(1R,4S,5R)-2-azabicyclo[2.2.1]heptane-5-carbonitrile
CAS No: 1909287-58-6 Catalog No: AG01C57L MDL No:
Product Description
Catalog Number:
AG01C57L
Chemical Name:
rac-(1R,4S,5R)-2-azabicyclo[2.2.1]heptane-5-carbonitrile
CAS Number:
1909287-58-6
Molecular Formula:
C7H10N2
Molecular Weight:
122.1677
IUPAC Name:
(1R,4S,5R)-2-azabicyclo[2.2.1]heptane-5-carbonitrile
InChI:
InChI=1S/C7H10N2/c8-3-5-1-7-2-6(5)4-9-7/h5-7,9H,1-2,4H2/t5-,6+,7-/m0/s1
InChI Key:
ZYGSYWNTOIZIMA-XVMARJQXSA-N
SMILES:
N#C[C@@H]1C[C@H]2C[C@@H]1CN2
Properties
Complexity:
167
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
3
Defined Bond Stereocenter Count:
0
Exact Mass:
122.084g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
122.171g/mol
Monoisotopic Mass:
122.084g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
35.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.1
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