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Home > Other Heterocycles > 1823499-10-0
1823499-10-0 | (8-AZABICYCLO[3.2.1]OCTAN-3-YL)(THIOPHEN-2-YL)METHANONE HYDROCHLORIDE
CAS No: 1823499-10-0 Catalog No: AG01AS63 MDL No:MFCD28166039
Product Description
Catalog Number:
AG01AS63
Chemical Name:
(8-AZABICYCLO[3.2.1]OCTAN-3-YL)(THIOPHEN-2-YL)METHANONE HYDROCHLORIDE
CAS Number:
1823499-10-0
Molecular Formula:
C12H16ClNOS
Molecular Weight:
257.7795
MDL Number:
MFCD28166039
IUPAC Name:
8-azabicyclo[3.2.1]octan-3-yl(thiophen-2-yl)methanone;hydrochloride
InChI:
InChI=1S/C12H15NOS.ClH/c14-12(11-2-1-5-15-11)8-6-9-3-4-10(7-8)13-9;/h1-2,5,8-10,13H,3-4,6-7H2;1H
InChI Key:
DFGUGUVPLBETML-UHFFFAOYSA-N
SMILES:
O=C(c1cccs1)C1CC2CCC(C1)N2.Cl
Properties
Complexity:
256
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
257.064g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
257.776g/mol
Monoisotopic Mass:
257.064g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
57.3A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
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