(5Z,6Z)-1-ethyl-5-ethylidene-6-propylidenecyclohexa-1,3-diene

C13H18 — CID 145297250

IUPAC(5Z,6Z)-1-ethyl-5-ethylidene-6-propylidenecyclohexa-1,3-diene
SMILESC/C=c1/cccc(CC)/c1=C/CC
InChIInChI=1S/C13H18/c1-4-8-13-11(5-2)9-7-10-12(13)6-3/h5,7-10H,4,6H2,1-3H3/b11-5-,13-8+
InChIKeyDZKOXSJEXHMJHW-LRJPFJPCSA-N
MW174.29 g/mol
LogP2.24
Rot. Bonds2

About (5Z,6Z)-1-ethyl-5-ethylidene-6-propylidenecyclohexa-1,3-diene

(5Z,6Z)-1-ethyl-5-ethylidene-6-propylidenecyclohexa-1,3-diene (PubChem CID 145297250) has the molecular formula C13H18 and a molecular weight of 174.29 g/mol. Its IUPAC name is (5Z,6Z)-1-ethyl-5-ethylidene-6-propylidenecyclohexa-1,3-diene.

Molecular Properties

Compound Name(5Z,6Z)-1-ethyl-5-ethylidene-6-propylidenecyclohexa-1,3-diene
PubChem CID145297250
Molecular FormulaC13H18
Molecular Weight174.29 g/mol
Exact Mass174.14
IUPAC Name(5Z,6Z)-1-ethyl-5-ethylidene-6-propylidenecyclohexa-1,3-diene
SMILESC/C=c1/cccc(CC)/c1=C/CC
InChIInChI=1S/C13H18/c1-4-8-13-11(5-2)9-7-10-12(13)6-3/h5,7-10H,4,6H2,1-3H3/b11-5-,13-8+
InChIKeyDZKOXSJEXHMJHW-LRJPFJPCSA-N
XLogP2.24
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500174.29
LogP ≤ 52.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of (5Z,6Z)-1-ethyl-5-ethylidene-6-propylidenecyclohexa-1,3-diene?
The IUPAC name of (5Z,6Z)-1-ethyl-5-ethylidene-6-propylidenecyclohexa-1,3-diene (CID 145297250) is (5Z,6Z)-1-ethyl-5-ethylidene-6-propylidenecyclohexa-1,3-diene.
What is the SMILES notation for (5Z,6Z)-1-ethyl-5-ethylidene-6-propylidenecyclohexa-1,3-diene?
The canonical SMILES for (5Z,6Z)-1-ethyl-5-ethylidene-6-propylidenecyclohexa-1,3-diene is C/C=c1/cccc(CC)/c1=C/CC.
What is the InChIKey of (5Z,6Z)-1-ethyl-5-ethylidene-6-propylidenecyclohexa-1,3-diene?
The InChIKey is DZKOXSJEXHMJHW-LRJPFJPCSA-N. The full InChI is InChI=1S/C13H18/c1-4-8-13-11(5-2)9-7-10-12(13)6-3/h5,7-10H,4,6H2,1-3H3/b11-5-,13-8+.
What are the key properties of (5Z,6Z)-1-ethyl-5-ethylidene-6-propylidenecyclohexa-1,3-diene?
(5Z,6Z)-1-ethyl-5-ethylidene-6-propylidenecyclohexa-1,3-diene has a molecular weight of 174.29 g/mol, XLogP of 2.24, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (5Z,6Z)-1-ethyl-5-ethylidene-6-propylidenecyclohexa-1,3-diene is sourced from PubChem (CID 145297250), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).