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1,3-Cyclopentadiene, 5,5-dimethyl-

HCID 138124
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Basic information

CAS
4125-18-2
Standard SMILES
CC1(C)C=CC=C1
InChIKey
QWJWPDHACGGABF-UHFFFAOYSA-N
Molecular formula
C7H10
Average molar mass
94.15 g/mol
Monoisotopic mass
94.07825032

Names & identifiers

Preferred name
1,3-Cyclopentadiene, 5,5-dimethyl-
IUPAC
5,5-dimethylcyclopenta-1,3-diene
English name
1,3-Cyclopentadiene, 5,5-dimethyl-
Molecular formula
C7H10
Molecular weight
94.15

Names & synonyms

1,3-Cyclopentadiene, 5,5-dimethyl-4125-18-2DTXSID60194171RefChem:1052772DTXCID701166625,5-Dimethylcyclopentadiene5,5-dimethylcyclopenta-1,3-diene5,5-Dimethyl-1,3-cyclopentadieneSCHEMBL2357367SCHEMBL4646678SCHEMBL282397455,5-dimethyl-cyclopenta-1,3-diene
Show more names
1,1-Dimethyl-2,4-cyclopentadiene
5,5-Dimethyl-1,3-cyclopentadiene #

Database identifiers

CAS
4125-18-2
PubChem CID
138124
DTXSID
DTXSID60194171
Nikkaji
J102.053F

Properties

Computed structural properties

XLogP
2.7
Topological polar surface area
0 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
0
Rotatable bonds
0
Heavy atoms
7
Formal charge
0
Complexity
102

Experimental & physicochemical properties

SpringerMaterials PropertiesDiamagnetic susceptibility

Physicochemical properties

Boiling point
47 °C · 47 °C(Press: 11 Torr)
Density
0.7838 g/cm3 · 0.7838 g/cm3

Related reactions

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Compound notes

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