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Home Other Building Blocks Tetramethylcyclopentadiene

Tetramethylcyclopentadiene

CAS No.:
4249-10-9
Catalog Number:
AG003DAB
Molecular Formula:
C9H14
Molecular Weight:
122.2075
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
85%
In Stock USA
United States
$77
- +
5g
85%
In Stock USA
United States
$263
- +
25g
85%
In Stock USA
United States
$1125
- +
Product Description
Catalog Number:
AG003DAB
Chemical Name:
Tetramethylcyclopentadiene
CAS Number:
4249-10-9
Molecular Formula:
C9H14
Molecular Weight:
122.2075
MDL Number:
MFCD00145385
InChI:
InChI=1S/C9H14/c1-6-5-7(2)9(4)8(6)3/h5H2,1-4H3
InChI Key:
VNPQQEYMXYCAEZ-UHFFFAOYSA-N
SMILES:
CC1=C(C)C(=C(C1)C)C
Properties
Complexity:
170  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
122.11g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
122.211g/mol
Monoisotopic Mass:
122.11g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5  
Literature
Title Journal
Ultrafast curve crossing dynamics through conical intersections in methylated cyclopentadienes. The journal of physical chemistry. A 20100408
1,2,3,4-Tetra-methyl-cyclo-pent-2-ene-1,4-diol. Acta crystallographica. Section E, Structure reports online 20081001
Properties