(1Z,3Z,5Z,7Z)-1,2,3,4,5,6,7,8-octapropylcycloocta-1,3,5,7-tetraene

C32H56 — CID 6312601

IUPAC(1Z,3Z,5Z,7Z)-1,2,3,4,5,6,7,8-octapropylcycloocta-1,3,5,7-tetraene
SMILESCCCC1=C(CCC)/C(CCC)=C(CCC)\C(CCC)=C(CCC)/C(CCC)=C\1CCC
InChIInChI=1S/C32H56/c1-9-17-25-26(18-10-2)28(20-12-4)30(22-14-6)32(24-16-8)31(23-15-7)29(21-13-5)27(25)19-11-3/h9-24H2,1-8H3/b26-25-,27-25-,28-26-,29-27-,30-28-,31-29-,32-30-,32-31-
InChIKeyDVDSCPGPRRGJKR-UCEPNMPGSA-N
MW440.80 g/mol
LogP11.59
Rot. Bonds16

About (1Z,3Z,5Z,7Z)-1,2,3,4,5,6,7,8-octapropylcycloocta-1,3,5,7-tetraene

(1Z,3Z,5Z,7Z)-1,2,3,4,5,6,7,8-octapropylcycloocta-1,3,5,7-tetraene (PubChem CID 6312601) has the molecular formula C32H56 and a molecular weight of 440.80 g/mol. Its IUPAC name is (1Z,3Z,5Z,7Z)-1,2,3,4,5,6,7,8-octapropylcycloocta-1,3,5,7-tetraene.

Molecular Properties

Compound Name(1Z,3Z,5Z,7Z)-1,2,3,4,5,6,7,8-octapropylcycloocta-1,3,5,7-tetraene
PubChem CID6312601
Molecular FormulaC32H56
Molecular Weight440.80 g/mol
Exact Mass440.44
IUPAC Name(1Z,3Z,5Z,7Z)-1,2,3,4,5,6,7,8-octapropylcycloocta-1,3,5,7-tetraene
SMILESCCCC1=C(CCC)/C(CCC)=C(CCC)\C(CCC)=C(CCC)/C(CCC)=C\1CCC
InChIInChI=1S/C32H56/c1-9-17-25-26(18-10-2)28(20-12-4)30(22-14-6)32(24-16-8)31(23-15-7)29(21-13-5)27(25)19-11-3/h9-24H2,1-8H3/b26-25-,27-25-,28-26-,29-27-,30-28-,31-29-,32-30-,32-31-
InChIKeyDVDSCPGPRRGJKR-UCEPNMPGSA-N
XLogP11.59
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds16
Heavy Atoms32
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500440.80
LogP ≤ 511.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Analyze (1Z,3Z,5Z,7Z)-1,2,3,4,5,6,7,8-octapropylcycloocta-1,3,5,7-tetraene with MolForge

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Frequently Asked Questions

What is the IUPAC name of (1Z,3Z,5Z,7Z)-1,2,3,4,5,6,7,8-octapropylcycloocta-1,3,5,7-tetraene?
The IUPAC name of (1Z,3Z,5Z,7Z)-1,2,3,4,5,6,7,8-octapropylcycloocta-1,3,5,7-tetraene (CID 6312601) is (1Z,3Z,5Z,7Z)-1,2,3,4,5,6,7,8-octapropylcycloocta-1,3,5,7-tetraene.
What is the SMILES notation for (1Z,3Z,5Z,7Z)-1,2,3,4,5,6,7,8-octapropylcycloocta-1,3,5,7-tetraene?
The canonical SMILES for (1Z,3Z,5Z,7Z)-1,2,3,4,5,6,7,8-octapropylcycloocta-1,3,5,7-tetraene is CCCC1=C(CCC)/C(CCC)=C(CCC)\C(CCC)=C(CCC)/C(CCC)=C\1CCC.
What is the InChIKey of (1Z,3Z,5Z,7Z)-1,2,3,4,5,6,7,8-octapropylcycloocta-1,3,5,7-tetraene?
The InChIKey is DVDSCPGPRRGJKR-UCEPNMPGSA-N. The full InChI is InChI=1S/C32H56/c1-9-17-25-26(18-10-2)28(20-12-4)30(22-14-6)32(24-16-8)31(23-15-7)29(21-13-5)27(25)19-11-3/h9-24H2,1-8H3/b26-25-,27-25-,28-26-,29-27-,30-28-,31-29-,32-30-,32-31-.
What are the key properties of (1Z,3Z,5Z,7Z)-1,2,3,4,5,6,7,8-octapropylcycloocta-1,3,5,7-tetraene?
(1Z,3Z,5Z,7Z)-1,2,3,4,5,6,7,8-octapropylcycloocta-1,3,5,7-tetraene has a molecular weight of 440.80 g/mol, XLogP of 11.59, 16 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (1Z,3Z,5Z,7Z)-1,2,3,4,5,6,7,8-octapropylcycloocta-1,3,5,7-tetraene is sourced from PubChem (CID 6312601), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).