penta-1,2,3,4-tetraene;prop-1-ene

C8H10 — CID 91432943

IUPACpenta-1,2,3,4-tetraene;prop-1-ene
SMILESC=C=C=C=C.C=CC
InChIInChI=1S/C5H4.C3H6/c1-3-5-4-2;1-3-2/h1-2H2;3H,1H2,2H3
InChIKeyOGTFBABRVQAFHI-UHFFFAOYSA-N
MW106.17 g/mol
LogP2.46
Rot. Bonds

About penta-1,2,3,4-tetraene;prop-1-ene

penta-1,2,3,4-tetraene;prop-1-ene (PubChem CID 91432943) has the molecular formula C8H10 and a molecular weight of 106.17 g/mol. Its IUPAC name is penta-1,2,3,4-tetraene;prop-1-ene.

Molecular Properties

Compound Namepenta-1,2,3,4-tetraene;prop-1-ene
PubChem CID91432943
Molecular FormulaC8H10
Molecular Weight106.17 g/mol
Exact Mass106.08
IUPAC Namepenta-1,2,3,4-tetraene;prop-1-ene
SMILESC=C=C=C=C.C=CC
InChIInChI=1S/C5H4.C3H6/c1-3-5-4-2;1-3-2/h1-2H2;3H,1H2,2H3
InChIKeyOGTFBABRVQAFHI-UHFFFAOYSA-N
XLogP2.46
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500106.17
LogP ≤ 52.46
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

prop-1-ene
CID 162178440
hexa-1,2,3,4-tetraene
CID 11815814
λ2-plumbane;prop-1-ene
CID 173103273
ethene;tetrakis(prop-1-ene)
CID 158667737
ethane;tetrakis(prop-1-ene)
CID 90918926
azane;tris(prop-1-ene)
CID 162019717
ethane;bis(prop-1-ene)
CID 91426438
azane;tris(prop-1-ene)
CID 173323353
prop-1-ene;hydrochloride
CID 19097823
bis(prop-1-ene);hydrate
CID 21257591
methanamine;prop-1-ene
CID 174317036
pentacontahecta-1,2,3,4,5,6,7,8,9,10,11,12,13,14,15,16,17,18,19,20,21,22,23,24,25,26,27,28,29,30,31,32,33,34,35,36,37,38,39,40,41,42,43,44,45,46,47,48,49,50,51,52,53,54,55,56,57,58,59,60,61,62,63,64,65,66,67,68,69,70,71,72,73,74,75,76,77,78,79,80,81,82,83,84,85,86,87,88,89,90,91,92,93,94,95,96,97,98,99,100,101,102,103,104,105,106,107,108,109,110,111,112,113,114,115,116,117,118,119,120,121,122,123,124,125,126,127,128,129,130,131,132,133,134,135,136,137,138,139,140,141,142,143,144,145,146,147,148,149-nonatetracontahectaene
CID 23559593

Frequently Asked Questions

What is the IUPAC name of penta-1,2,3,4-tetraene;prop-1-ene?
The IUPAC name of penta-1,2,3,4-tetraene;prop-1-ene (CID 91432943) is penta-1,2,3,4-tetraene;prop-1-ene.
What is the SMILES notation for penta-1,2,3,4-tetraene;prop-1-ene?
The canonical SMILES for penta-1,2,3,4-tetraene;prop-1-ene is C=C=C=C=C.C=CC.
What is the InChIKey of penta-1,2,3,4-tetraene;prop-1-ene?
The InChIKey is OGTFBABRVQAFHI-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H4.C3H6/c1-3-5-4-2;1-3-2/h1-2H2;3H,1H2,2H3.
What are the key properties of penta-1,2,3,4-tetraene;prop-1-ene?
penta-1,2,3,4-tetraene;prop-1-ene has a molecular weight of 106.17 g/mol, XLogP of 2.46, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for penta-1,2,3,4-tetraene;prop-1-ene is sourced from PubChem (CID 91432943), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).