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2175-91-9

2175-91-9 | 5-Propan-2-Ylidenecyclopenta-1,3-Diene

CAS No: 2175-91-9 Catalog No: AG0037TT MDL No:MFCD00011655

Product Description

Catalog Number:
AG0037TT
Chemical Name:
5-Propan-2-Ylidenecyclopenta-1,3-Diene
CAS Number:
2175-91-9
Molecular Formula:
C8H10
Molecular Weight:
106.1650
MDL Number:
MFCD00011655
IUPAC Name:
5-propan-2-ylidenecyclopenta-1,3-diene
InChI:
InChI=1S/C8H10/c1-7(2)8-5-3-4-6-8/h3-6H,1-2H3
InChI Key:
WXACXMWYHXOSIX-UHFFFAOYSA-N
SMILES:
CC(=C1C=CC=C1)C
NSC Number:
132350

Properties

Complexity:
151  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
106.078g/mol
Formal Charge:
0
Heavy Atom Count:
8  
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
106.168g/mol
Monoisotopic Mass:
106.078g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8  

Literature

Title Journal
Triphenylphosphine reduction of saturated endoperoxides. Organic letters 20090903
Internally solvated cyclopentadienyllithium compounds: structural integrity of the Cp-Li+ moiety. NMR, dynamics, X-ray crystallography, and calculations. The Journal of organic chemistry 20051111
Synthesis and structural characterization of mono- and bisfunctional o-carboranes. Dalton transactions (Cambridge, England : 2003) 20050721
Reaction of 2,2-bis(trifluoromethyl)-1,1-dicyanoethylene with 6,6-dimethylfulvene: cycloadditions and a rearrangement. The Journal of organic chemistry 20030110
Alpha-amino acids with metallocenyl side chains. Chemistry (Weinheim an der Bergstrasse, Germany) 20020202

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