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Home > Other Heterocycles > 17159-87-4
17159-87-4 | Bicyclo[3.1.1]heptan-2-one
CAS No: 17159-87-4 Catalog No: AG00HZJT MDL No:MFCD19689157
Product Description
Catalog Number:
AG00HZJT
Chemical Name:
Bicyclo[3.1.1]heptan-2-one
CAS Number:
17159-87-4
Molecular Formula:
C7H10O
Molecular Weight:
110.1537
MDL Number:
MFCD19689157
IUPAC Name:
bicyclo[3.1.1]heptan-2-one
InChI:
InChI=1S/C7H10O/c8-7-2-1-5-3-6(7)4-5/h5-6H,1-4H2
InChI Key:
PMAXNHPFNDQMAO-UHFFFAOYSA-N
SMILES:
O=C1CCC2CC1C2
Properties
Complexity:
122
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
110.073g/mol
Formal Charge:
0
Heavy Atom Count:
8
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
110.156g/mol
Monoisotopic Mass:
110.073g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8
Literature
| Title | Journal |
|---|---|
| Temperature effect of tapered element oscillating microbalance (TEOM) system measuring semi-volatile organic particulate matter. | Journal of environmental monitoring : JEM 20110401 |
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