1,1-dimethyl-3-methylidenecyclohexane;ethane

C11H22 — CID 91238646

IUPAC1,1-dimethyl-3-methylidenecyclohexane;ethane
SMILESC=C1CCCC(C)(C)C1.CC
InChIInChI=1S/C9H16.C2H6/c1-8-5-4-6-9(2,3)7-8;1-2/h1,4-7H2,2-3H3;1-2H3
InChIKeyHGADUZKVZWTGBX-UHFFFAOYSA-N
MW154.30 g/mol
LogP4.17
Rot. Bonds

About 1,1-dimethyl-3-methylidenecyclohexane;ethane

1,1-dimethyl-3-methylidenecyclohexane;ethane (PubChem CID 91238646) has the molecular formula C11H22 and a molecular weight of 154.30 g/mol. Its IUPAC name is 1,1-dimethyl-3-methylidenecyclohexane;ethane.

Molecular Properties

Compound Name1,1-dimethyl-3-methylidenecyclohexane;ethane
PubChem CID91238646
Molecular FormulaC11H22
Molecular Weight154.30 g/mol
Exact Mass154.17
IUPAC Name1,1-dimethyl-3-methylidenecyclohexane;ethane
SMILESC=C1CCCC(C)(C)C1.CC
InChIInChI=1S/C9H16.C2H6/c1-8-5-4-6-9(2,3)7-8;1-2/h1,4-7H2,2-3H3;1-2H3
InChIKeyHGADUZKVZWTGBX-UHFFFAOYSA-N
XLogP4.17
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.30
LogP ≤ 54.17
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

1-methyl-3-methylidenecyclohexan-1-ol
CID 23345654
6,6-dimethyl-1,2,3,4,5,7,8,9-octahydrobenzo[7]annulene;ethane
CID 142014547
2-(1-methyl-3-methylidenecyclohexyl)acetonitrile
CID 10796911
3,3-dimethylcycloheptan-1-one
CID 12702041
1,1-difluoro-3-methylidenecyclopentane;uranium
CID 142596182
methane;1,2,4,4-tetramethylcyclohexene
CID 153358945
2-methyl-4-[2-[(1R)-1-methyl-3-methylidenecyclohexyl]ethoxy]butan-2-ol
CID 54265768
(2Z)-2-(3,3-dimethylcyclohexylidene)acetonitrile
CID 146675962
(1-methyl-3-methylidenecyclopentyl)methylphosphane
CID 161459121
4,4,7,7-tetramethyl-1,2,3,5,6,8-hexahydronaphthalene
CID 175928717
2-bromo-3,7,7-trimethylcyclooct-2-en-1-one
CID 131870973
2-chloro-3,7,7-trimethylcyclooct-2-en-1-one
CID 72732904

Frequently Asked Questions

What is the IUPAC name of 1,1-dimethyl-3-methylidenecyclohexane;ethane?
The IUPAC name of 1,1-dimethyl-3-methylidenecyclohexane;ethane (CID 91238646) is 1,1-dimethyl-3-methylidenecyclohexane;ethane.
What is the SMILES notation for 1,1-dimethyl-3-methylidenecyclohexane;ethane?
The canonical SMILES for 1,1-dimethyl-3-methylidenecyclohexane;ethane is C=C1CCCC(C)(C)C1.CC.
What is the InChIKey of 1,1-dimethyl-3-methylidenecyclohexane;ethane?
The InChIKey is HGADUZKVZWTGBX-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16.C2H6/c1-8-5-4-6-9(2,3)7-8;1-2/h1,4-7H2,2-3H3;1-2H3.
What are the key properties of 1,1-dimethyl-3-methylidenecyclohexane;ethane?
1,1-dimethyl-3-methylidenecyclohexane;ethane has a molecular weight of 154.30 g/mol, XLogP of 4.17, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1,1-dimethyl-3-methylidenecyclohexane;ethane is sourced from PubChem (CID 91238646), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).