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Home > Other Heterocycles > 16554-83-9
16554-83-9 | Bicyclo[4.1.0]hept-3-ene
CAS No: 16554-83-9 Catalog No: AG001W82 MDL No:
Product Description
Catalog Number:
AG001W82
Chemical Name:
Bicyclo[4.1.0]hept-3-ene
CAS Number:
16554-83-9
Molecular Formula:
C7H10
Molecular Weight:
94.1543
IUPAC Name:
bicyclo[4.1.0]hept-3-ene
InChI:
InChI=1S/C7H10/c1-2-4-7-5-6(7)3-1/h1-2,6-7H,3-5H2
InChI Key:
JBFDZEJAJZJORO-UHFFFAOYSA-N
SMILES:
C1=CCC2C(C1)C2
Properties
Complexity:
90.6
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
94.078g/mol
Formal Charge:
0
Heavy Atom Count:
7
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
94.157g/mol
Monoisotopic Mass:
94.078g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
Literature
| Title | Journal |
|---|---|
| Computational study of the mechanisms of the photoisomerization reactions of bicycloalkene. | The journal of physical chemistry. A 20101104 |
| Desaturase reactions complicate the use of norcarane as a mechanistic probe. Unraveling the mixture of twenty-plus products formed in enzyme-catalyzed oxidations of norcarane. | The Journal of organic chemistry 20070216 |
| Products from enzyme-catalyzed oxidations of norcarenes. | The Journal of organic chemistry 20070216 |
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