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Home > Imidazoles > 1706451-08-2
1706451-08-2 | 3-[(1-methyl-1H-imidazol-2-yl)sulfanyl]-8-azabicyclo[3.2.1]octane
CAS No: 1706451-08-2 Catalog No: AG01APEJ MDL No:MFCD29034687
Product Description
Catalog Number:
AG01APEJ
Chemical Name:
3-[(1-methyl-1H-imidazol-2-yl)sulfanyl]-8-azabicyclo[3.2.1]octane
CAS Number:
1706451-08-2
MDL Number:
MFCD29034687
IUPAC Name:
3-(1-methylimidazol-2-yl)sulfanyl-8-azabicyclo[3.2.1]octane
InChI:
InChI=1S/C11H17N3S/c1-14-5-4-12-11(14)15-10-6-8-2-3-9(7-10)13-8/h4-5,8-10,13H,2-3,6-7H2,1H3
InChI Key:
BHDKCDBPKVBKGR-UHFFFAOYSA-N
Properties
Complexity:
224
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
223.114g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
223.338g/mol
Monoisotopic Mass:
223.114g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
55.2A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
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