(1Z,3Z,5Z,6Z,7Z)-5-ethylidene-6-(2-methylpropylidene)-8-phenyl-7-propylidenecycloocta-1,3-diene

C23H28 — CID 142288384

IUPAC(1Z,3Z,5Z,6Z,7Z)-5-ethylidene-6-(2-methylpropylidene)-8-phenyl-7-propylidenecycloocta-1,3-diene
SMILESC/C=C1/C=C\C=C/C(c2ccccc2)C(=C/CC)/C1=C\C(C)C
InChIInChI=1S/C23H28/c1-5-12-22-21(20-14-8-7-9-15-20)16-11-10-13-19(6-2)23(22)17-18(3)4/h6-18,21H,5H2,1-4H3/b13-10-,16-11-,19-6-,22-12-,23-17-
InChIKeyHNHJCOSDUGJEIF-SIPRLMPJSA-N
MW304.48 g/mol
LogP6.76
Rot. Bonds3

About (1Z,3Z,5Z,6Z,7Z)-5-ethylidene-6-(2-methylpropylidene)-8-phenyl-7-propylidenecycloocta-1,3-diene

(1Z,3Z,5Z,6Z,7Z)-5-ethylidene-6-(2-methylpropylidene)-8-phenyl-7-propylidenecycloocta-1,3-diene (PubChem CID 142288384) has the molecular formula C23H28 and a molecular weight of 304.48 g/mol. Its IUPAC name is (1Z,3Z,5Z,6Z,7Z)-5-ethylidene-6-(2-methylpropylidene)-8-phenyl-7-propylidenecycloocta-1,3-diene.

Molecular Properties

Compound Name(1Z,3Z,5Z,6Z,7Z)-5-ethylidene-6-(2-methylpropylidene)-8-phenyl-7-propylidenecycloocta-1,3-diene
PubChem CID142288384
Molecular FormulaC23H28
Molecular Weight304.48 g/mol
Exact Mass304.22
IUPAC Name(1Z,3Z,5Z,6Z,7Z)-5-ethylidene-6-(2-methylpropylidene)-8-phenyl-7-propylidenecycloocta-1,3-diene
SMILESC/C=C1/C=C\C=C/C(c2ccccc2)C(=C/CC)/C1=C\C(C)C
InChIInChI=1S/C23H28/c1-5-12-22-21(20-14-8-7-9-15-20)16-11-10-13-19(6-2)23(22)17-18(3)4/h6-18,21H,5H2,1-4H3/b13-10-,16-11-,19-6-,22-12-,23-17-
InChIKeyHNHJCOSDUGJEIF-SIPRLMPJSA-N
XLogP6.76
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500304.48
LogP ≤ 56.76
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

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5,6-di(propylidene)bicyclo[2.2.1]hept-2-ene
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[(2-ethylcyclopenta-2,4-dien-1-yl)-phenylmethyl]benzene
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(5Z)-1-ethyl-5-ethylidenecyclopenta-1,3-diene
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3-(difluoromethyl)-3-ethyl-6-phenylcyclohexa-1,4-diene
CID 23205704
5-chloro-5-methyl-6-phenylcyclohexa-1,3-diene
CID 70549664
4,7-dimethyl-1-phenyl-1H-indene
CID 86724422
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CID 11985593
(4-phenylcyclohexa-2,5-dien-1-yl)benzene
CID 5248482
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CID 59892983

Frequently Asked Questions

What is the IUPAC name of (1Z,3Z,5Z,6Z,7Z)-5-ethylidene-6-(2-methylpropylidene)-8-phenyl-7-propylidenecycloocta-1,3-diene?
The IUPAC name of (1Z,3Z,5Z,6Z,7Z)-5-ethylidene-6-(2-methylpropylidene)-8-phenyl-7-propylidenecycloocta-1,3-diene (CID 142288384) is (1Z,3Z,5Z,6Z,7Z)-5-ethylidene-6-(2-methylpropylidene)-8-phenyl-7-propylidenecycloocta-1,3-diene.
What is the SMILES notation for (1Z,3Z,5Z,6Z,7Z)-5-ethylidene-6-(2-methylpropylidene)-8-phenyl-7-propylidenecycloocta-1,3-diene?
The canonical SMILES for (1Z,3Z,5Z,6Z,7Z)-5-ethylidene-6-(2-methylpropylidene)-8-phenyl-7-propylidenecycloocta-1,3-diene is C/C=C1/C=C\C=C/C(c2ccccc2)C(=C/CC)/C1=C\C(C)C.
What is the InChIKey of (1Z,3Z,5Z,6Z,7Z)-5-ethylidene-6-(2-methylpropylidene)-8-phenyl-7-propylidenecycloocta-1,3-diene?
The InChIKey is HNHJCOSDUGJEIF-SIPRLMPJSA-N. The full InChI is InChI=1S/C23H28/c1-5-12-22-21(20-14-8-7-9-15-20)16-11-10-13-19(6-2)23(22)17-18(3)4/h6-18,21H,5H2,1-4H3/b13-10-,16-11-,19-6-,22-12-,23-17-.
What are the key properties of (1Z,3Z,5Z,6Z,7Z)-5-ethylidene-6-(2-methylpropylidene)-8-phenyl-7-propylidenecycloocta-1,3-diene?
(1Z,3Z,5Z,6Z,7Z)-5-ethylidene-6-(2-methylpropylidene)-8-phenyl-7-propylidenecycloocta-1,3-diene has a molecular weight of 304.48 g/mol, XLogP of 6.76, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (1Z,3Z,5Z,6Z,7Z)-5-ethylidene-6-(2-methylpropylidene)-8-phenyl-7-propylidenecycloocta-1,3-diene is sourced from PubChem (CID 142288384), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).