(4R)-5,6-dimethylidenebicyclo[2.2.1]hept-2-ene

C9H10 — CID 134964182

IUPAC(4R)-5,6-dimethylidenebicyclo[2.2.1]hept-2-ene
SMILESC=C1C(=C)[C@H]2C=CC1C2
InChIInChI=1S/C9H10/c1-6-7(2)9-4-3-8(6)5-9/h3-4,8-9H,1-2,5H2/t8-,9?/m0/s1
InChIKeyLEHFKOPSVFOJDF-IENPIDJESA-N
MW118.18 g/mol
LogP2.30
Rot. Bonds

About (4R)-5,6-dimethylidenebicyclo[2.2.1]hept-2-ene

(4R)-5,6-dimethylidenebicyclo[2.2.1]hept-2-ene (PubChem CID 134964182) has the molecular formula C9H10 and a molecular weight of 118.18 g/mol. Its IUPAC name is (4R)-5,6-dimethylidenebicyclo[2.2.1]hept-2-ene.

Molecular Properties

Compound Name(4R)-5,6-dimethylidenebicyclo[2.2.1]hept-2-ene
PubChem CID134964182
Molecular FormulaC9H10
Molecular Weight118.18 g/mol
Exact Mass118.08
IUPAC Name(4R)-5,6-dimethylidenebicyclo[2.2.1]hept-2-ene
SMILESC=C1C(=C)[C@H]2C=CC1C2
InChIInChI=1S/C9H10/c1-6-7(2)9-4-3-8(6)5-9/h3-4,8-9H,1-2,5H2/t8-,9?/m0/s1
InChIKeyLEHFKOPSVFOJDF-IENPIDJESA-N
XLogP2.30
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500118.18
LogP ≤ 52.30
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,4R)-5,6-dimethylidenebicyclo[2.2.2]oct-2-ene
CID 124556656
(1R,3S,6R,8S)-tetracyclo[6.2.2.13,6.02,7]trideca-2(7),4,9-triene
CID 101270230
4-methyl-5-methylidenetricyclo[6.2.1.02,7]undeca-2(7),9-diene-3,6-dione
CID 123380347
trimethyl-(3-trimethylsilyl-2-bicyclo[2.2.1]hepta-2,5-dienyl)silane
CID 71362852
(1S,4S)-bicyclo[2.2.1]hepta-2,5-diene-2,3-dicarboxylic acid
CID 98045467
3-(iodomethyl)-5-methylidenecyclopentene
CID 163770356
[(1S,2R,4R)-3-methylidene-2-bicyclo[2.2.1]hept-5-enyl]methanol
CID 13005438
10-methylidenetricyclo[4.3.1.03,8]dec-4-ene
CID 121219171
(1S,5R,8S,12R)-3,10-dimethoxypentacyclo[10.2.1.15,8.02,11.04,9]hexadeca-2,4(9),6,10,13-pentaene
CID 14971118
2-bromo-3-iodobicyclo[2.2.1]hepta-2,5-diene
CID 101050470
5,6-di(propylidene)bicyclo[2.2.1]hept-2-ene
CID 141101625
bicyclo[2.2.1]hept-5-en-2-one;ethene
CID 67271465

Frequently Asked Questions

What is the IUPAC name of (4R)-5,6-dimethylidenebicyclo[2.2.1]hept-2-ene?
The IUPAC name of (4R)-5,6-dimethylidenebicyclo[2.2.1]hept-2-ene (CID 134964182) is (4R)-5,6-dimethylidenebicyclo[2.2.1]hept-2-ene.
What is the SMILES notation for (4R)-5,6-dimethylidenebicyclo[2.2.1]hept-2-ene?
The canonical SMILES for (4R)-5,6-dimethylidenebicyclo[2.2.1]hept-2-ene is C=C1C(=C)[C@H]2C=CC1C2.
What is the InChIKey of (4R)-5,6-dimethylidenebicyclo[2.2.1]hept-2-ene?
The InChIKey is LEHFKOPSVFOJDF-IENPIDJESA-N. The full InChI is InChI=1S/C9H10/c1-6-7(2)9-4-3-8(6)5-9/h3-4,8-9H,1-2,5H2/t8-,9?/m0/s1.
What are the key properties of (4R)-5,6-dimethylidenebicyclo[2.2.1]hept-2-ene?
(4R)-5,6-dimethylidenebicyclo[2.2.1]hept-2-ene has a molecular weight of 118.18 g/mol, XLogP of 2.30, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (4R)-5,6-dimethylidenebicyclo[2.2.1]hept-2-ene is sourced from PubChem (CID 134964182), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).