3-(2,3-dimethylbut-2-enylidene)cyclopropene

C9H12 — CID 123150563

IUPAC3-(2,3-dimethylbut-2-enylidene)cyclopropene
SMILESCC(C)=C(C)C=C1C=C1
InChIInChI=1S/C9H12/c1-7(2)8(3)6-9-4-5-9/h4-6H,1-3H3
InChIKeyFYVBPUMKKAGSQS-UHFFFAOYSA-N
MW120.19 g/mol
LogP2.84
Rot. Bonds1

About 3-(2,3-dimethylbut-2-enylidene)cyclopropene

3-(2,3-dimethylbut-2-enylidene)cyclopropene (PubChem CID 123150563) has the molecular formula C9H12 and a molecular weight of 120.19 g/mol. Its IUPAC name is 3-(2,3-dimethylbut-2-enylidene)cyclopropene.

Molecular Properties

Compound Name3-(2,3-dimethylbut-2-enylidene)cyclopropene
PubChem CID123150563
Molecular FormulaC9H12
Molecular Weight120.19 g/mol
Exact Mass120.09
IUPAC Name3-(2,3-dimethylbut-2-enylidene)cyclopropene
SMILESCC(C)=C(C)C=C1C=C1
InChIInChI=1S/C9H12/c1-7(2)8(3)6-9-4-5-9/h4-6H,1-3H3
InChIKeyFYVBPUMKKAGSQS-UHFFFAOYSA-N
XLogP2.84
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500120.19
LogP ≤ 52.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

2-cycloprop-2-en-1-ylideneacetic acid
CID 131854742
(2E)-2-(2,3-dimethylbut-2-enylidene)-3-methylidenepyrazine
CID 146437046
3,4-dimethylpenta-1,3-diene
CID 6713443
2-[1-(1-methyl-4-pyridinylidene)propan-2-ylidene]indene-1,3-dione
CID 57456325
(1E)-3,4-dimethylpenta-1,3-dien-1-ol
CID 173388634
(5Z)-2-chloro-5-(chloromethylidene)cyclopenta-1,3-diene
CID 45090405
(4E,7E,11E)-2,3-dimethyltrideca-2,4,7,11-tetraene
CID 87328569
N,2,3-trimethylbut-2-en-1-imine
CID 123452663
(4Z,6E)-6-methoxy-2,3-dimethylocta-2,4,6-triene
CID 177034485
(2E,4Z,5E)-2-(2,3-dimethylbut-2-enylidene)-4-ethylidene-3-methylidene-5-prop-2-enylideneoxolane
CID 89174867
(4Z)-2,3,5,7-tetramethylocta-2,4,6-triene
CID 142272318
(1Z)-3,4-dimethylpenta-1,3-dien-1-amine;ethane
CID 144535129

Frequently Asked Questions

What is the IUPAC name of 3-(2,3-dimethylbut-2-enylidene)cyclopropene?
The IUPAC name of 3-(2,3-dimethylbut-2-enylidene)cyclopropene (CID 123150563) is 3-(2,3-dimethylbut-2-enylidene)cyclopropene.
What is the SMILES notation for 3-(2,3-dimethylbut-2-enylidene)cyclopropene?
The canonical SMILES for 3-(2,3-dimethylbut-2-enylidene)cyclopropene is CC(C)=C(C)C=C1C=C1.
What is the InChIKey of 3-(2,3-dimethylbut-2-enylidene)cyclopropene?
The InChIKey is FYVBPUMKKAGSQS-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12/c1-7(2)8(3)6-9-4-5-9/h4-6H,1-3H3.
What are the key properties of 3-(2,3-dimethylbut-2-enylidene)cyclopropene?
3-(2,3-dimethylbut-2-enylidene)cyclopropene has a molecular weight of 120.19 g/mol, XLogP of 2.84, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2,3-dimethylbut-2-enylidene)cyclopropene is sourced from PubChem (CID 123150563), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).