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Home > Other Heterocycles > 2059948-57-9
2059948-57-9 | 6-ethyl-7-azabicyclo[4.2.0]octane
CAS No: 2059948-57-9 Catalog No: AG01BPGC MDL No:MFCD30500219
Product Description
Catalog Number:
AG01BPGC
Chemical Name:
6-ethyl-7-azabicyclo[4.2.0]octane
CAS Number:
2059948-57-9
Molecular Formula:
C9H17N
Molecular Weight:
139.2380
MDL Number:
MFCD30500219
IUPAC Name:
6-ethyl-7-azabicyclo[4.2.0]octane
InChI:
InChI=1S/C9H17N/c1-2-9-6-4-3-5-8(9)7-10-9/h8,10H,2-7H2,1H3
InChI Key:
LNNAMYVHJNGRQS-UHFFFAOYSA-N
SMILES:
CCC12CCCCC2CN1
Properties
Complexity:
133
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:
1
Topological Polar Surface Area:
12A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
2
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