(1Z,3E,5E,8Z,10E)-6-ethenyl-2,8,10-trimethyl-5-[(Z)-prop-1-enyl]bicyclo[9.5.0]hexadeca-1,3,5,8,10,13,15-heptaene

C24H28 — CID 143620439

IUPAC(1Z,3E,5E,8Z,10E)-6-ethenyl-2,8,10-trimethyl-5-[(Z)-prop-1-enyl]bicyclo[9.5.0]hexadeca-1,3,5,8,10,13,15-heptaene
SMILESC=C/C1=C(\C=C/C)/C=C/C(C)=C2/C=CC=CC/C2=C(C)\C=C(\C)C1
InChIInChI=1S/C24H28/c1-6-11-22-15-14-19(4)23-12-9-8-10-13-24(23)20(5)16-18(3)17-21(22)7-2/h6-12,14-16H,2,13,17H2,1,3-5H3/b11-6-,15-14+,18-16-,22-21-,23-19-,24-20+
InChIKeyPMOXBSFYVIUXIF-PQBCKLHNSA-N
MW316.49 g/mol
LogP7.10
Rot. Bonds2

About (1Z,3E,5E,8Z,10E)-6-ethenyl-2,8,10-trimethyl-5-[(Z)-prop-1-enyl]bicyclo[9.5.0]hexadeca-1,3,5,8,10,13,15-heptaene

(1Z,3E,5E,8Z,10E)-6-ethenyl-2,8,10-trimethyl-5-[(Z)-prop-1-enyl]bicyclo[9.5.0]hexadeca-1,3,5,8,10,13,15-heptaene (PubChem CID 143620439) has the molecular formula C24H28 and a molecular weight of 316.49 g/mol. Its IUPAC name is (1Z,3E,5E,8Z,10E)-6-ethenyl-2,8,10-trimethyl-5-[(Z)-prop-1-enyl]bicyclo[9.5.0]hexadeca-1,3,5,8,10,13,15-heptaene.

Molecular Properties

Compound Name(1Z,3E,5E,8Z,10E)-6-ethenyl-2,8,10-trimethyl-5-[(Z)-prop-1-enyl]bicyclo[9.5.0]hexadeca-1,3,5,8,10,13,15-heptaene
PubChem CID143620439
Molecular FormulaC24H28
Molecular Weight316.49 g/mol
Exact Mass316.22
IUPAC Name(1Z,3E,5E,8Z,10E)-6-ethenyl-2,8,10-trimethyl-5-[(Z)-prop-1-enyl]bicyclo[9.5.0]hexadeca-1,3,5,8,10,13,15-heptaene
SMILESC=C/C1=C(\C=C/C)/C=C/C(C)=C2/C=CC=CC/C2=C(C)\C=C(\C)C1
InChIInChI=1S/C24H28/c1-6-11-22-15-14-19(4)23-12-9-8-10-13-24(23)20(5)16-18(3)17-21(22)7-2/h6-12,14-16H,2,13,17H2,1,3-5H3/b11-6-,15-14+,18-16-,22-21-,23-19-,24-20+
InChIKeyPMOXBSFYVIUXIF-PQBCKLHNSA-N
XLogP7.10
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500316.49
LogP ≤ 57.10
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Analyze (1Z,3E,5E,8Z,10E)-6-ethenyl-2,8,10-trimethyl-5-[(Z)-prop-1-enyl]bicyclo[9.5.0]hexadeca-1,3,5,8,10,13,15-heptaene with MolForge

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Launch Full Analysis

Related Compounds

ethane;1-ethenyl-2-[(Z)-prop-1-enyl]cyclopenta-1,3-diene;2-ethylcyclopentan-1-ol
CID 144517174
3-ethenyl-2-methyl-4-[(Z)-prop-1-enyl]cyclohepta-1,3,5-triene
CID 156829668
2-ethenyl-3-[(Z)-prop-1-enyl]-1H-pyrrol-1-ium
CID 143136443
ethane;1,2,4-tris(ethenyl)-3-[(Z)-prop-1-enyl]cyclopenta-1,3-diene
CID 142480313
ethane;4-ethenyl-2-methyl-5-[(Z)-prop-1-enyl]-3H-pyrrole
CID 142986985
ethane;2-ethenyl-3-methyl-4H-cyclohepta[b]thiophene
CID 142399260
2-ethenyl-N,N,6-trimethylcyclohepta-1,4,6-trien-1-amine
CID 143195302
5-methyl-4,7-dihydro-3H-cyclopenta[a]pentalene
CID 157152475
2-ethenyl-3-[(Z)-prop-1-enyl]-1H-indene
CID 58975510
3-ethenyl-1-methyl-2-[(Z)-prop-1-enyl]-4H-phosphinoline
CID 171624006
ethane;2-ethenyl-7-methyl-3-[(Z)-prop-1-enyl]-1H-indene
CID 143520012
8H-azulen-1-one
CID 163209393

Frequently Asked Questions

What is the IUPAC name of (1Z,3E,5E,8Z,10E)-6-ethenyl-2,8,10-trimethyl-5-[(Z)-prop-1-enyl]bicyclo[9.5.0]hexadeca-1,3,5,8,10,13,15-heptaene?
The IUPAC name of (1Z,3E,5E,8Z,10E)-6-ethenyl-2,8,10-trimethyl-5-[(Z)-prop-1-enyl]bicyclo[9.5.0]hexadeca-1,3,5,8,10,13,15-heptaene (CID 143620439) is (1Z,3E,5E,8Z,10E)-6-ethenyl-2,8,10-trimethyl-5-[(Z)-prop-1-enyl]bicyclo[9.5.0]hexadeca-1,3,5,8,10,13,15-heptaene.
What is the SMILES notation for (1Z,3E,5E,8Z,10E)-6-ethenyl-2,8,10-trimethyl-5-[(Z)-prop-1-enyl]bicyclo[9.5.0]hexadeca-1,3,5,8,10,13,15-heptaene?
The canonical SMILES for (1Z,3E,5E,8Z,10E)-6-ethenyl-2,8,10-trimethyl-5-[(Z)-prop-1-enyl]bicyclo[9.5.0]hexadeca-1,3,5,8,10,13,15-heptaene is C=C/C1=C(\C=C/C)/C=C/C(C)=C2/C=CC=CC/C2=C(C)\C=C(\C)C1.
What is the InChIKey of (1Z,3E,5E,8Z,10E)-6-ethenyl-2,8,10-trimethyl-5-[(Z)-prop-1-enyl]bicyclo[9.5.0]hexadeca-1,3,5,8,10,13,15-heptaene?
The InChIKey is PMOXBSFYVIUXIF-PQBCKLHNSA-N. The full InChI is InChI=1S/C24H28/c1-6-11-22-15-14-19(4)23-12-9-8-10-13-24(23)20(5)16-18(3)17-21(22)7-2/h6-12,14-16H,2,13,17H2,1,3-5H3/b11-6-,15-14+,18-16-,22-21-,23-19-,24-20+.
What are the key properties of (1Z,3E,5E,8Z,10E)-6-ethenyl-2,8,10-trimethyl-5-[(Z)-prop-1-enyl]bicyclo[9.5.0]hexadeca-1,3,5,8,10,13,15-heptaene?
(1Z,3E,5E,8Z,10E)-6-ethenyl-2,8,10-trimethyl-5-[(Z)-prop-1-enyl]bicyclo[9.5.0]hexadeca-1,3,5,8,10,13,15-heptaene has a molecular weight of 316.49 g/mol, XLogP of 7.10, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (1Z,3E,5E,8Z,10E)-6-ethenyl-2,8,10-trimethyl-5-[(Z)-prop-1-enyl]bicyclo[9.5.0]hexadeca-1,3,5,8,10,13,15-heptaene is sourced from PubChem (CID 143620439), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).