icosa-2,4,6,8,10,12,14,16,18-nonayne

C20H6 — CID 22082360

IUPACicosa-2,4,6,8,10,12,14,16,18-nonayne
SMILESCC#CC#CC#CC#CC#CC#CC#CC#CC#CC
InChIInChI=1S/C20H6/c1-3-5-7-9-11-13-15-17-19-20-18-16-14-12-10-8-6-4-2/h1-2H3
InChIKeyMANPHPUOIYLADL-UHFFFAOYSA-N
MW246.27 g/mol
LogP1.06
Rot. Bonds

About icosa-2,4,6,8,10,12,14,16,18-nonayne

icosa-2,4,6,8,10,12,14,16,18-nonayne (PubChem CID 22082360) has the molecular formula C20H6 and a molecular weight of 246.27 g/mol. Its IUPAC name is icosa-2,4,6,8,10,12,14,16,18-nonayne.

Molecular Properties

Compound Nameicosa-2,4,6,8,10,12,14,16,18-nonayne
PubChem CID22082360
Molecular FormulaC20H6
Molecular Weight246.27 g/mol
Exact Mass246.05
IUPAC Nameicosa-2,4,6,8,10,12,14,16,18-nonayne
SMILESCC#CC#CC#CC#CC#CC#CC#CC#CC#CC
InChIInChI=1S/C20H6/c1-3-5-7-9-11-13-15-17-19-20-18-16-14-12-10-8-6-4-2/h1-2H3
InChIKeyMANPHPUOIYLADL-UHFFFAOYSA-N
XLogP1.06
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.27
LogP ≤ 51.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'triple_bond', 'substructure': 'N/A'}

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Related Compounds

tetratetracontahecta-2,4,6,8,10,12,14,16,18,20,22,24,26,28,30,32,34,36,38,40,42,44,46,48,50,52,54,56,58,60,62,64,66,68,70,72,74,76,78,80,82,84,86,88,90,92,94,96,98,100,102,104,106,108,110,112,114,116,118,120,122,124,126,128,130,132,134,136,138,140,142-henheptacontayne
CID 123192391
octaoctacontahecta-2,4,6,8,10,12,14,16,18,20,22,24,26,28,30,32,34,36,38,40,42,44,46,48,50,52,54,56,58,60,62,64,66,68,70,72,74,76,78,80,82,84,86,88,90,92,94,96,98,100,102,104,106,108,110,112,114,116,118,120,122,124,126,128,130,132,134,136,138,140,142,144,146,148,150,152,154,156,158,160,162,164,166,168,170,172,174,176,178,180,182,184,186-trinonacontayne
CID 123157218
hexaconta-2,4,6,8,10,12,14,16,18,20,22,24,26,28,30,32,34,36,38,40,42,44,46,48,50,52,54,56,58-nonacosayne
CID 21343619
cyclopropane;hexaconta-2,4,6,8,10,12,14,16,18,20,22,24,26,28,30,32,34,36,38,40,42,44,46,48,50,52,54,56,58-nonacosayne
CID 91199081
1-iodonona-1,3,5,7-tetrayne
CID 126629440
1-bromohepta-1,3,5-triyne
CID 20735643
tritriacontahecta-1,3,5,7,9,11,13,15,17,19,21,23,25,27,29,31,33,35,37,39,41,43,45,47,49,51,53,55,57,59,61,63,65,67,69,71,73,75,77,79,81,83,85,87,89,91,93,95,97,99,101,103,105,107,109,111,113,115,117,119,121,123,125,127,129,131-hexahexacontayne
CID 58354339
nonahexaconta-1,3,5,7,9,11,13,15,17,19,21,23,25,27,29,31,33,35,37,39,41,43,45,47,49,51,53,55,57,59,61,63,65,67-tetratriacontayne
CID 177268470
dotriaconta-2,4,6,8,10,12,14,16,18,20,22,24,26,28,30-pentadecaynenitrile
CID 59741338
nona-1,3,5,7-tetrayne
CID 59907654
pentaoctaconta-1,3,5,7,9,11,13,15,17,19,21,23,25,27,29,31,33,35,37,39,41,43,45,47,49,51,53,55,57,59,61,63,65,67,69,71,73,75,77,79,81,83-dotetracontayne
CID 162450541
heptatriacontadicta-1,3,5,7,9,11,13,15,17,19,21,23,25,27,29,31,33,35,37,39,41,43,45,47,49,51,53,55,57,59,61,63,65,67,69,71,73,75,77,79,81,83,85,87,89,91,93,95,97,99,101,103,105,107,109,111,113,115,117,119,121,123,125,127,129,131,133,135,137,139,141,143,145,147,149,151,153,155,157,159,161,163,165,167,169,171,173,175,177,179,181,183,185,187,189,191,193,195,197,199,201,203,205,207,209,211,213,215,217,219,221,223,225,227,229,231,233,235-octadecahectayne
CID 162450540

Frequently Asked Questions

What is the IUPAC name of icosa-2,4,6,8,10,12,14,16,18-nonayne?
The IUPAC name of icosa-2,4,6,8,10,12,14,16,18-nonayne (CID 22082360) is icosa-2,4,6,8,10,12,14,16,18-nonayne.
What is the SMILES notation for icosa-2,4,6,8,10,12,14,16,18-nonayne?
The canonical SMILES for icosa-2,4,6,8,10,12,14,16,18-nonayne is CC#CC#CC#CC#CC#CC#CC#CC#CC#CC.
What is the InChIKey of icosa-2,4,6,8,10,12,14,16,18-nonayne?
The InChIKey is MANPHPUOIYLADL-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H6/c1-3-5-7-9-11-13-15-17-19-20-18-16-14-12-10-8-6-4-2/h1-2H3.
What are the key properties of icosa-2,4,6,8,10,12,14,16,18-nonayne?
icosa-2,4,6,8,10,12,14,16,18-nonayne has a molecular weight of 246.27 g/mol, XLogP of 1.06, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for icosa-2,4,6,8,10,12,14,16,18-nonayne is sourced from PubChem (CID 22082360), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).