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Home > Other Heterocycles > 2126160-91-4
2126160-91-4 | 1-ethynyl-2-azabicyclo[2.1.1]hexane hydrochloride
CAS No: 2126160-91-4 Catalog No: AG01EMS9 MDL No:MFCD31381424
Product Description
Catalog Number:
AG01EMS9
Chemical Name:
1-ethynyl-2-azabicyclo[2.1.1]hexane hydrochloride
CAS Number:
2126160-91-4
Molecular Formula:
C7H10ClN
Molecular Weight:
143.6140
MDL Number:
MFCD31381424
IUPAC Name:
1-ethynyl-2-azabicyclo[2.1.1]hexane;hydrochloride
InChI:
InChI=1S/C7H9N.ClH/c1-2-7-3-6(4-7)5-8-7;/h1,6,8H,3-5H2;1H
InChI Key:
ZNJFROWJKBEOKJ-UHFFFAOYSA-N
SMILES:
C#CC12NCC(C1)C2.Cl
Properties
Complexity:
157
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
143.05g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
143.614g/mol
Monoisotopic Mass:
143.05g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
12A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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