6-methylidene-2-propan-2-ylcyclohexa-1,3-diene

C10H14 — CID 90709253

IUPAC6-methylidene-2-propan-2-ylcyclohexa-1,3-diene
SMILESC=C1C=C(C(C)C)C=CC1
InChIInChI=1S/C10H14/c1-8(2)10-6-4-5-9(3)7-10/h4,6-8H,3,5H2,1-2H3
InChIKeyYALXMFRBGMUIMX-UHFFFAOYSA-N
MW134.22 g/mol
LogP3.08
Rot. Bonds1

About 6-methylidene-2-propan-2-ylcyclohexa-1,3-diene

6-methylidene-2-propan-2-ylcyclohexa-1,3-diene (PubChem CID 90709253) has the molecular formula C10H14 and a molecular weight of 134.22 g/mol. Its IUPAC name is 6-methylidene-2-propan-2-ylcyclohexa-1,3-diene.

Molecular Properties

Compound Name6-methylidene-2-propan-2-ylcyclohexa-1,3-diene
PubChem CID90709253
Molecular FormulaC10H14
Molecular Weight134.22 g/mol
Exact Mass134.11
IUPAC Name6-methylidene-2-propan-2-ylcyclohexa-1,3-diene
SMILESC=C1C=C(C(C)C)C=CC1
InChIInChI=1S/C10H14/c1-8(2)10-6-4-5-9(3)7-10/h4,6-8H,3,5H2,1-2H3
InChIKeyYALXMFRBGMUIMX-UHFFFAOYSA-N
XLogP3.08
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500134.22
LogP ≤ 53.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

1-(3-methylidenecyclohexa-1,5-dien-1-yl)ethanone
CID 91334375
4-propan-2-ylcyclohepta-1,3,5-trien-1-amine
CID 143215023
6-methylidene-2-[2-(3-methylidenecyclohexa-1,5-dien-1-yl)ethyl]cyclohexa-1,3-diene
CID 136734752
hafnium;2-propan-2-ylcyclopenta-1,3-diene
CID 175311105
4-propan-2-ylcyclohepta-3,6-diene-1,2-dione
CID 130031149
5-methylidenecyclohexa-1,3-diene;dihydrobromide
CID 175171179
5-methylidene-2-(3-methylidenecyclohexa-1,5-dien-1-yl)cyclohexa-1,3-diene
CID 173128708
6-methylidene-2-phenylcyclohexa-1,3-diene;sulfane
CID 145149614
(1E,5Z,10S)-3,7-dimethylidene-10-propan-2-ylcyclodeca-1,5-diene
CID 165345238
3-propan-2-ylcyclohexa-2,4-dien-1-amine
CID 146359524
dimethyl-(2-propan-2-ylcyclopenta-1,3-dien-1-yl)silane
CID 102435122
2-methylidene-6,7-di(propan-2-yl)-1,3-dihydroazepine
CID 162270844

Frequently Asked Questions

What is the IUPAC name of 6-methylidene-2-propan-2-ylcyclohexa-1,3-diene?
The IUPAC name of 6-methylidene-2-propan-2-ylcyclohexa-1,3-diene (CID 90709253) is 6-methylidene-2-propan-2-ylcyclohexa-1,3-diene.
What is the SMILES notation for 6-methylidene-2-propan-2-ylcyclohexa-1,3-diene?
The canonical SMILES for 6-methylidene-2-propan-2-ylcyclohexa-1,3-diene is C=C1C=C(C(C)C)C=CC1.
What is the InChIKey of 6-methylidene-2-propan-2-ylcyclohexa-1,3-diene?
The InChIKey is YALXMFRBGMUIMX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14/c1-8(2)10-6-4-5-9(3)7-10/h4,6-8H,3,5H2,1-2H3.
What are the key properties of 6-methylidene-2-propan-2-ylcyclohexa-1,3-diene?
6-methylidene-2-propan-2-ylcyclohexa-1,3-diene has a molecular weight of 134.22 g/mol, XLogP of 3.08, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methylidene-2-propan-2-ylcyclohexa-1,3-diene is sourced from PubChem (CID 90709253), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).