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Home > Other Heterocycles > 28405-47-2
28405-47-2 | BICYCLO[6.1.0]NONAN-4-ONE
CAS No: 28405-47-2 Catalog No: AG01C0MJ MDL No:MFCD24691001
Product Description
Catalog Number:
AG01C0MJ
Chemical Name:
BICYCLO[6.1.0]NONAN-4-ONE
CAS Number:
28405-47-2
Molecular Formula:
C9H14O
Molecular Weight:
138.2069
MDL Number:
MFCD24691001
IUPAC Name:
bicyclo[6.1.0]nonan-4-one
InChI:
InChI=1S/C9H14O/c10-9-3-1-2-7-6-8(7)4-5-9/h7-8H,1-6H2
InChI Key:
UDHNUIAVTOMCDR-UHFFFAOYSA-N
SMILES:
O=C1CCCC2C(CC1)C2
Properties
Complexity:
151
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
138.104g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
138.21g/mol
Monoisotopic Mass:
138.104g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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