bicyclo[4.3.1]deca-2,7-diene

C10H14 — CID 150088804

IUPACbicyclo[4.3.1]deca-2,7-diene
SMILESC1=CC2CC=CC(CC1)C2
InChIInChI=1S/C10H14/c1-2-5-10-7-3-6-9(4-1)8-10/h1,3-4,7,9-10H,2,5-6,8H2
InChIKeyDSUDWGMBEKLIJZ-UHFFFAOYSA-N
MW134.22 g/mol
LogP2.92
Rot. Bonds

About bicyclo[4.3.1]deca-2,7-diene

bicyclo[4.3.1]deca-2,7-diene (PubChem CID 150088804) has the molecular formula C10H14 and a molecular weight of 134.22 g/mol. Its IUPAC name is bicyclo[4.3.1]deca-2,7-diene.

Molecular Properties

Compound Namebicyclo[4.3.1]deca-2,7-diene
PubChem CID150088804
Molecular FormulaC10H14
Molecular Weight134.22 g/mol
Exact Mass134.11
IUPAC Namebicyclo[4.3.1]deca-2,7-diene
SMILESC1=CC2CC=CC(CC1)C2
InChIInChI=1S/C10H14/c1-2-5-10-7-3-6-9(4-1)8-10/h1,3-4,7,9-10H,2,5-6,8H2
InChIKeyDSUDWGMBEKLIJZ-UHFFFAOYSA-N
XLogP2.92
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500134.22
LogP ≤ 52.92
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

(1R,4S)-bicyclo[2.2.1]hept-2-ene
CID 638051
bicyclo[8.3.1]tetradec-11-ene
CID 175573202
bicyclo[2.2.1]hept-2-ene;bis(bicyclo[3.1.1]hept-2-ene);bicyclo[3.2.0]hept-2-ene;bicyclo[4.1.0]hept-2-ene;bicyclo[4.1.0]hept-3-ene;methane
CID 158282656
bicyclo[2.2.1]hept-2-ene;tris(cyclopenta-1,3-diene)
CID 173404323
2,4a,4b,7,8,8a,9,9a-octahydro-1H-fluorene
CID 91529219
bicyclo[2.2.1]hept-2-ene;naphthalene
CID 175477679
(2E,8E)-tricyclo[10.3.0.05,7]pentadeca-2,8-diene
CID 142484210
bicyclo[2.2.1]hept-2-ene;trichlororhodium
CID 175974959
(3S)-3-methylcyclopentene
CID 11018803
(1S)-cyclopent-2-en-1-ol
CID 11789128
cyclopent-2-en-1-ylphosphane
CID 141088996
2-methylbicyclo[3.3.1]nona-2,6-diene
CID 78155727

Frequently Asked Questions

What is the IUPAC name of bicyclo[4.3.1]deca-2,7-diene?
The IUPAC name of bicyclo[4.3.1]deca-2,7-diene (CID 150088804) is bicyclo[4.3.1]deca-2,7-diene.
What is the SMILES notation for bicyclo[4.3.1]deca-2,7-diene?
The canonical SMILES for bicyclo[4.3.1]deca-2,7-diene is C1=CC2CC=CC(CC1)C2.
What is the InChIKey of bicyclo[4.3.1]deca-2,7-diene?
The InChIKey is DSUDWGMBEKLIJZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14/c1-2-5-10-7-3-6-9(4-1)8-10/h1,3-4,7,9-10H,2,5-6,8H2.
What are the key properties of bicyclo[4.3.1]deca-2,7-diene?
bicyclo[4.3.1]deca-2,7-diene has a molecular weight of 134.22 g/mol, XLogP of 2.92, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for bicyclo[4.3.1]deca-2,7-diene is sourced from PubChem (CID 150088804), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).