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Home > Other Heterocycles > 2059974-68-2
2059974-68-2 | 1,6-dimethyl-7-azabicyclo[4.2.0]octane
CAS No: 2059974-68-2 Catalog No: AG01BPGB MDL No:MFCD30500218
Product Description
Catalog Number:
AG01BPGB
Chemical Name:
1,6-dimethyl-7-azabicyclo[4.2.0]octane
CAS Number:
2059974-68-2
Molecular Formula:
C9H17N
Molecular Weight:
139.2380
MDL Number:
MFCD30500218
IUPAC Name:
1,6-dimethyl-7-azabicyclo[4.2.0]octane
InChI:
InChI=1S/C9H17N/c1-8-5-3-4-6-9(8,2)10-7-8/h10H,3-7H2,1-2H3
InChI Key:
LSECVPDXYDSENS-UHFFFAOYSA-N
SMILES:
CC12CCCCC2(NC1)C
Properties
Complexity:
155
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
139.136g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
139.242g/mol
Monoisotopic Mass:
139.136g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
12A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
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