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15507-35-4 | Benzene, (1-cyclopenten-1-ylmethyl)-
CAS No: 15507-35-4 Catalog No: AG001NLQ MDL No:
Product Description
Catalog Number:
AG001NLQ
Chemical Name:
Benzene, (1-cyclopenten-1-ylmethyl)-
CAS Number:
15507-35-4
Molecular Formula:
C12H14
Molecular Weight:
158.2396
IUPAC Name:
cyclopenten-1-ylmethylbenzene
InChI:
InChI=1S/C12H14/c1-2-6-11(7-3-1)10-12-8-4-5-9-12/h1-3,6-8H,4-5,9-10H2
InChI Key:
GSXCQGUOLCBELU-UHFFFAOYSA-N
SMILES:
c1ccc(cc1)CC1=CCCC1
Properties
Complexity:
161
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
158.11g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
158.244g/mol
Monoisotopic Mass:
158.11g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4
Literature
| Title | Journal |
|---|---|
| One- and two-photon-induced ring-cleavage reactions of strained benzocycloalkenes via hot molecules. | The journal of physical chemistry. A 20050811 |
| Non-aromatic endocyclic angle at the ring fusion with the aromatic ring in benzocyclopentene and -hexene, revisited. | Acta crystallographica. Section B, Structural science 20040601 |
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