2,2-dimethyl-3-methylidenebicyclo[2.2.1]heptane;6,6-dimethyl-2-methylidenebicyclo[3.1.1]heptane;(3E)-3,7-dimethylocta-1,3,6-triene;2-methylbuta-1,3-diene;4-methylidene-1-propan-2-ylbicyclo[3.1.0]hexane;3-methylidene-6-propan-2-ylcyclohexene;7-methyl-3-methylideneocta-1,6-diene;2-methyl-5-propan-2-ylbicyclo[3.1.0]hex-2-ene;1-methyl-4-propan-2-ylcyclohexa-1,3-diene;1-methyl-4-propan-2-ylcyclohexa-1,4-diene;1-methyl-4-propan-2-ylidenecyclohexene;1-methyl-4-prop-1-en-2-ylcyclohexene;2,6,6-trimethylbicyclo[3.1.1]hept-2-ene;3,7,7-trimethylbicyclo[4.1.0]hept-3-ene

C135H216 — CID 160599030

About 2,2-dimethyl-3-methylidenebicyclo[2.2.1]heptane;6,6-dimethyl-2-methylidenebicyclo[3.1.1]heptane;(3E)-3,7-dimethylocta-1,3,6-triene;2-methylbuta-1,3-diene;4-methylidene-1-propan-2-ylbicyclo[3.1.0]hexane;3-methylidene-6-propan-2-ylcyclohexene;7-methyl-3-methylideneocta-1,6-diene;2-methyl-5-propan-2-ylbicyclo[3.1.0]hex-2-ene;1-methyl-4-propan-2-ylcyclohexa-1,3-diene;1-methyl-4-propan-2-ylcyclohexa-1,4-diene;1-methyl-4-propan-2-ylidenecyclohexene;1-methyl-4-prop-1-en-2-ylcyclohexene;2,6,6-trimethylbicyclo[3.1.1]hept-2-ene;3,7,7-trimethylbicyclo[4.1.0]hept-3-ene

2,2-dimethyl-3-methylidenebicyclo[2.2.1]heptane;6,6-dimethyl-2-methylidenebicyclo[3.1.1]heptane;(3E)-3,7-dimethylocta-1,3,6-triene;2-methylbuta-1,3-diene;4-methylidene-1-propan-2-ylbicyclo[3.1.0]hexane;3-methylidene-6-propan-2-ylcyclohexene;7-methyl-3-methylideneocta-1,6-diene;2-methyl-5-propan-2-ylbicyclo[3.1.0]hex-2-ene;1-methyl-4-propan-2-ylcyclohexa-1,3-diene;1-methyl-4-propan-2-ylcyclohexa-1,4-diene;1-methyl-4-propan-2-ylidenecyclohexene;1-methyl-4-prop-1-en-2-ylcyclohexene;2,6,6-trimethylbicyclo[3.1.1]hept-2-ene;3,7,7-trimethylbicyclo[4.1.0]hept-3-ene (PubChem CID 160599030) has the molecular formula C135H216 and a molecular weight of 1839.21 g/mol. Its IUPAC name is 2,2-dimethyl-3-methylidenebicyclo[2.2.1]heptane;6,6-dimethyl-2-methylidenebicyclo[3.1.1]heptane;(3E)-3,7-dimethylocta-1,3,6-triene;2-methylbuta-1,3-diene;4-methylidene-1-propan-2-ylbicyclo[3.1.0]hexane;3-methylidene-6-propan-2-ylcyclohexene;7-methyl-3-methylideneocta-1,6-diene;2-methyl-5-propan-2-ylbicyclo[3.1.0]hex-2-ene;1-methyl-4-propan-2-ylcyclohexa-1,3-diene;1-methyl-4-propan-2-ylcyclohexa-1,4-diene;1-methyl-4-propan-2-ylidenecyclohexene;1-methyl-4-prop-1-en-2-ylcyclohexene;2,6,6-trimethylbicyclo[3.1.1]hept-2-ene;3,7,7-trimethylbicyclo[4.1.0]hept-3-ene.

Molecular Properties

• Compound Name: 2,2-dimethyl-3-methylidenebicyclo[2.2.1]heptane;6,6-dimethyl-2-methylidenebicyclo[3.1.1]heptane;(3E)-3,7-dimethylocta-1,3,6-triene;2-methylbuta-1,3-diene;4-methylidene-1-propan-2-ylbicyclo[3.1.0]hexane;3-methylidene-6-propan-2-ylcyclohexene;7-methyl-3-methylideneocta-1,6-diene;2-methyl-5-propan-2-ylbicyclo[3.1.0]hex-2-ene;1-methyl-4-propan-2-ylcyclohexa-1,3-diene;1-methyl-4-propan-2-ylcyclohexa-1,4-diene;1-methyl-4-propan-2-ylidenecyclohexene;1-methyl-4-prop-1-en-2-ylcyclohexene;2,6,6-trimethylbicyclo[3.1.1]hept-2-ene;3,7,7-trimethylbicyclo[4.1.0]hept-3-ene
• PubChem CID: 160599030
• Molecular Formula: C135H216
• Molecular Weight: 1839.21 g/mol
• Exact Mass: 1837.69
• IUPAC Name: 2,2-dimethyl-3-methylidenebicyclo[2.2.1]heptane;6,6-dimethyl-2-methylidenebicyclo[3.1.1]heptane;(3E)-3,7-dimethylocta-1,3,6-triene;2-methylbuta-1,3-diene;4-methylidene-1-propan-2-ylbicyclo[3.1.0]hexane;3-methylidene-6-propan-2-ylcyclohexene;7-methyl-3-methylideneocta-1,6-diene;2-methyl-5-propan-2-ylbicyclo[3.1.0]hex-2-ene;1-methyl-4-propan-2-ylcyclohexa-1,3-diene;1-methyl-4-propan-2-ylcyclohexa-1,4-diene;1-methyl-4-propan-2-ylidenecyclohexene;1-methyl-4-prop-1-en-2-ylcyclohexene;2,6,6-trimethylbicyclo[3.1.1]hept-2-ene;3,7,7-trimethylbicyclo[4.1.0]hept-3-ene
• SMILES: C=C(C)C1CC=C(C)CC1.C=C/C(C)=C/CC=C(C)C.C=C1C2CCC(C2)C1(C)C.C=C1C=CC(C(C)C)CC1.C=C1CCC2(C(C)C)CC12.C=C1CCC2CC1C2(C)C.C=CC(=C)C.C=CC(=C)CCC=C(C)C.CC1=CC=C(C(C)C)CC1.CC1=CCC(=C(C)C)CC1.CC1=CCC(C(C)C)=CC1.CC1=CCC2(C(C)C)CC12.CC1=CCC2C(C1)C2(C)C.CC1=CCC2CC1C2(C)C
• InChI: InChI=1S/13C10H16.C5H8/c1-7-8-4-5-9(6-8)10(7,2)3;2*1-7-4-5-8-6-9(7)10(8,2)3;1-7-4-5-8-9(6-7)10(8,2)3;2*1-7(2)10-5-4-8(3)9(10)6-10;5*1-8(2)10-6-4-9(3)5-7-10;2*1-5-10(4)8-6-7-9(2)3;1-4-5(2)3/h8-9H,1,4-6H2,2-3H3;4,8-9H,5-6H2,1-3H3;8-9H,1,4-6H2,2-3H3;4,8-9H,5-6H2,1-3H3;4,7,9H,5-6H2,1-3H3;7,9H,3-6H2,1-2H3;4H,5-7H2,1-3H3;4,7-8H,5-6H2,1-3H3;4,6,8H,5,7H2,1-3H3;4,6,8,10H,3,5,7H2,1-2H3;4,10H,1,5-7H2,2-3H3;5,7-8H,1,6H2,2-4H3;5,7H,1,4,6,8H2,2-3H3;4H,1-2H2,3H3/b;;;;;;;;;;;10-8+
• InChIKey: REAHVZYXNLKMGA-WYLVHFDKSA-N
• XLogP: 43.24
• TPSA: 0.00 Ų
• Rotatable Bonds: 14
• Heavy Atoms: 135
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	1839.21
LogP ≤ 5	43.24
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	0

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 2,2-dimethyl-3-methylidenebicyclo[2.2.1]heptane;6,6-dimethyl-2-methylidenebicyclo[3.1.1]heptane;(3E)-3,7-dimethylocta-1,3,6-triene;2-methylbuta-1,3-diene;4-methylidene-1-propan-2-ylbicyclo[3.1.0]hexane;3-methylidene-6-propan-2-ylcyclohexene;7-methyl-3-methylideneocta-1,6-diene;2-methyl-5-propan-2-ylbicyclo[3.1.0]hex-2-ene;1-methyl-4-propan-2-ylcyclohexa-1,3-diene;1-methyl-4-propan-2-ylcyclohexa-1,4-diene;1-methyl-4-propan-2-ylidenecyclohexene;1-methyl-4-prop-1-en-2-ylcyclohexene;2,6,6-trimethylbicyclo[3.1.1]hept-2-ene;3,7,7-trimethylbicyclo[4.1.0]hept-3-ene?

The IUPAC name of 2,2-dimethyl-3-methylidenebicyclo[2.2.1]heptane;6,6-dimethyl-2-methylidenebicyclo[3.1.1]heptane;(3E)-3,7-dimethylocta-1,3,6-triene;2-methylbuta-1,3-diene;4-methylidene-1-propan-2-ylbicyclo[3.1.0]hexane;3-methylidene-6-propan-2-ylcyclohexene;7-methyl-3-methylideneocta-1,6-diene;2-methyl-5-propan-2-ylbicyclo[3.1.0]hex-2-ene;1-methyl-4-propan-2-ylcyclohexa-1,3-diene;1-methyl-4-propan-2-ylcyclohexa-1,4-diene;1-methyl-4-propan-2-ylidenecyclohexene;1-methyl-4-prop-1-en-2-ylcyclohexene;2,6,6-trimethylbicyclo[3.1.1]hept-2-ene;3,7,7-trimethylbicyclo[4.1.0]hept-3-ene (CID 160599030) is 2,2-dimethyl-3-methylidenebicyclo[2.2.1]heptane;6,6-dimethyl-2-methylidenebicyclo[3.1.1]heptane;(3E)-3,7-dimethylocta-1,3,6-triene;2-methylbuta-1,3-diene;4-methylidene-1-propan-2-ylbicyclo[3.1.0]hexane;3-methylidene-6-propan-2-ylcyclohexene;7-methyl-3-methylideneocta-1,6-diene;2-methyl-5-propan-2-ylbicyclo[3.1.0]hex-2-ene;1-methyl-4-propan-2-ylcyclohexa-1,3-diene;1-methyl-4-propan-2-ylcyclohexa-1,4-diene;1-methyl-4-propan-2-ylidenecyclohexene;1-methyl-4-prop-1-en-2-ylcyclohexene;2,6,6-trimethylbicyclo[3.1.1]hept-2-ene;3,7,7-trimethylbicyclo[4.1.0]hept-3-ene.

What is the SMILES notation for 2,2-dimethyl-3-methylidenebicyclo[2.2.1]heptane;6,6-dimethyl-2-methylidenebicyclo[3.1.1]heptane;(3E)-3,7-dimethylocta-1,3,6-triene;2-methylbuta-1,3-diene;4-methylidene-1-propan-2-ylbicyclo[3.1.0]hexane;3-methylidene-6-propan-2-ylcyclohexene;7-methyl-3-methylideneocta-1,6-diene;2-methyl-5-propan-2-ylbicyclo[3.1.0]hex-2-ene;1-methyl-4-propan-2-ylcyclohexa-1,3-diene;1-methyl-4-propan-2-ylcyclohexa-1,4-diene;1-methyl-4-propan-2-ylidenecyclohexene;1-methyl-4-prop-1-en-2-ylcyclohexene;2,6,6-trimethylbicyclo[3.1.1]hept-2-ene;3,7,7-trimethylbicyclo[4.1.0]hept-3-ene?

The canonical SMILES for 2,2-dimethyl-3-methylidenebicyclo[2.2.1]heptane;6,6-dimethyl-2-methylidenebicyclo[3.1.1]heptane;(3E)-3,7-dimethylocta-1,3,6-triene;2-methylbuta-1,3-diene;4-methylidene-1-propan-2-ylbicyclo[3.1.0]hexane;3-methylidene-6-propan-2-ylcyclohexene;7-methyl-3-methylideneocta-1,6-diene;2-methyl-5-propan-2-ylbicyclo[3.1.0]hex-2-ene;1-methyl-4-propan-2-ylcyclohexa-1,3-diene;1-methyl-4-propan-2-ylcyclohexa-1,4-diene;1-methyl-4-propan-2-ylidenecyclohexene;1-methyl-4-prop-1-en-2-ylcyclohexene;2,6,6-trimethylbicyclo[3.1.1]hept-2-ene;3,7,7-trimethylbicyclo[4.1.0]hept-3-ene is C=C(C)C1CC=C(C)CC1.C=C/C(C)=C/CC=C(C)C.C=C1C2CCC(C2)C1(C)C.C=C1C=CC(C(C)C)CC1.C=C1CCC2(C(C)C)CC12.C=C1CCC2CC1C2(C)C.C=CC(=C)C.C=CC(=C)CCC=C(C)C.CC1=CC=C(C(C)C)CC1.CC1=CCC(=C(C)C)CC1.CC1=CCC(C(C)C)=CC1.CC1=CCC2(C(C)C)CC12.CC1=CCC2C(C1)C2(C)C.CC1=CCC2CC1C2(C)C.

What is the InChIKey of 2,2-dimethyl-3-methylidenebicyclo[2.2.1]heptane;6,6-dimethyl-2-methylidenebicyclo[3.1.1]heptane;(3E)-3,7-dimethylocta-1,3,6-triene;2-methylbuta-1,3-diene;4-methylidene-1-propan-2-ylbicyclo[3.1.0]hexane;3-methylidene-6-propan-2-ylcyclohexene;7-methyl-3-methylideneocta-1,6-diene;2-methyl-5-propan-2-ylbicyclo[3.1.0]hex-2-ene;1-methyl-4-propan-2-ylcyclohexa-1,3-diene;1-methyl-4-propan-2-ylcyclohexa-1,4-diene;1-methyl-4-propan-2-ylidenecyclohexene;1-methyl-4-prop-1-en-2-ylcyclohexene;2,6,6-trimethylbicyclo[3.1.1]hept-2-ene;3,7,7-trimethylbicyclo[4.1.0]hept-3-ene?

The InChIKey is REAHVZYXNLKMGA-WYLVHFDKSA-N. The full InChI is InChI=1S/13C10H16.C5H8/c1-7-8-4-5-9(6-8)10(7,2)3;2*1-7-4-5-8-6-9(7)10(8,2)3;1-7-4-5-8-9(6-7)10(8,2)3;2*1-7(2)10-5-4-8(3)9(10)6-10;5*1-8(2)10-6-4-9(3)5-7-10;2*1-5-10(4)8-6-7-9(2)3;1-4-5(2)3/h8-9H,1,4-6H2,2-3H3;4,8-9H,5-6H2,1-3H3;8-9H,1,4-6H2,2-3H3;4,8-9H,5-6H2,1-3H3;4,7,9H,5-6H2,1-3H3;7,9H,3-6H2,1-2H3;4H,5-7H2,1-3H3;4,7-8H,5-6H2,1-3H3;4,6,8H,5,7H2,1-3H3;4,6,8,10H,3,5,7H2,1-2H3;4,10H,1,5-7H2,2-3H3;5,7-8H,1,6H2,2-4H3;5,7H,1,4,6,8H2,2-3H3;4H,1-2H2,3H3/b;;;;;;;;;;;10-8+;;.

What are the key properties of 2,2-dimethyl-3-methylidenebicyclo[2.2.1]heptane;6,6-dimethyl-2-methylidenebicyclo[3.1.1]heptane;(3E)-3,7-dimethylocta-1,3,6-triene;2-methylbuta-1,3-diene;4-methylidene-1-propan-2-ylbicyclo[3.1.0]hexane;3-methylidene-6-propan-2-ylcyclohexene;7-methyl-3-methylideneocta-1,6-diene;2-methyl-5-propan-2-ylbicyclo[3.1.0]hex-2-ene;1-methyl-4-propan-2-ylcyclohexa-1,3-diene;1-methyl-4-propan-2-ylcyclohexa-1,4-diene;1-methyl-4-propan-2-ylidenecyclohexene;1-methyl-4-prop-1-en-2-ylcyclohexene;2,6,6-trimethylbicyclo[3.1.1]hept-2-ene;3,7,7-trimethylbicyclo[4.1.0]hept-3-ene?

2,2-dimethyl-3-methylidenebicyclo[2.2.1]heptane;6,6-dimethyl-2-methylidenebicyclo[3.1.1]heptane;(3E)-3,7-dimethylocta-1,3,6-triene;2-methylbuta-1,3-diene;4-methylidene-1-propan-2-ylbicyclo[3.1.0]hexane;3-methylidene-6-propan-2-ylcyclohexene;7-methyl-3-methylideneocta-1,6-diene;2-methyl-5-propan-2-ylbicyclo[3.1.0]hex-2-ene;1-methyl-4-propan-2-ylcyclohexa-1,3-diene;1-methyl-4-propan-2-ylcyclohexa-1,4-diene;1-methyl-4-propan-2-ylidenecyclohexene;1-methyl-4-prop-1-en-2-ylcyclohexene;2,6,6-trimethylbicyclo[3.1.1]hept-2-ene;3,7,7-trimethylbicyclo[4.1.0]hept-3-ene has a molecular weight of 1839.21 g/mol, XLogP of 43.24, 14 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.

Where does this data come from?

All data for 2,2-dimethyl-3-methylidenebicyclo[2.2.1]heptane;6,6-dimethyl-2-methylidenebicyclo[3.1.1]heptane;(3E)-3,7-dimethylocta-1,3,6-triene;2-methylbuta-1,3-diene;4-methylidene-1-propan-2-ylbicyclo[3.1.0]hexane;3-methylidene-6-propan-2-ylcyclohexene;7-methyl-3-methylideneocta-1,6-diene;2-methyl-5-propan-2-ylbicyclo[3.1.0]hex-2-ene;1-methyl-4-propan-2-ylcyclohexa-1,3-diene;1-methyl-4-propan-2-ylcyclohexa-1,4-diene;1-methyl-4-propan-2-ylidenecyclohexene;1-methyl-4-prop-1-en-2-ylcyclohexene;2,6,6-trimethylbicyclo[3.1.1]hept-2-ene;3,7,7-trimethylbicyclo[4.1.0]hept-3-ene is sourced from PubChem (CID 160599030), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).