(6E)-6-(1-methoxyprop-2-enylidene)-1-methyl-5-methylidenecyclohexa-1,3-diene

Name: (6E)-6-(1-methoxyprop-2-enylidene)-1-methyl-5-methylidenecyclohexa-1,3-diene — Molecular Data
Creator: MolForge
License: https://creativecommons.org/publicdomain/zero/1.0/

C₁₂H₁₄O — CID 142213123

Data last refreshed: 2026-04-15 (MolForge compound catalog, from PubChem)

IUPAC(6E)-6-(1-methoxyprop-2-enylidene)-1-methyl-5-methylidenecyclohexa-1,3-diene

SMILESC=C/C(OC)=c1/c(C)cccc1=C

InChIInChI=1S/C12H14O/c1-5-11(13-4)12-9(2)7-6-8-10(12)3/h5-8H,1-2H2,3-4H3/b12-11-

InChIKeyCYKFTBYSTDEZTL-QXMHVHEDSA-N

MW174.24 g/mol

LogP1.35

Rot. Bonds2

About (6E)-6-(1-methoxyprop-2-enylidene)-1-methyl-5-methylidenecyclohexa-1,3-diene

(6E)-6-(1-methoxyprop-2-enylidene)-1-methyl-5-methylidenecyclohexa-1,3-diene (PubChem CID 142213123) has the molecular formula C₁₂H₁₄O and a molecular weight of 174.24 g/mol. Its IUPAC name is (6E)-6-(1-methoxyprop-2-enylidene)-1-methyl-5-methylidenecyclohexa-1,3-diene.

Molecular Properties

Compound Name	(6E)-6-(1-methoxyprop-2-enylidene)-1-methyl-5-methylidenecyclohexa-1,3-diene
PubChem CID	142213123
Molecular Formula	C₁₂H₁₄O
Molecular Weight	174.24 g/mol
Exact Mass	174.10
IUPAC Name	(6E)-6-(1-methoxyprop-2-enylidene)-1-methyl-5-methylidenecyclohexa-1,3-diene
SMILES	C=C/C(OC)=c1/c(C)cccc1=C
InChI	InChI=1S/C12H14O/c1-5-11(13-4)12-9(2)7-6-8-10(12)3/h5-8H,1-2H2,3-4H3/b12-11-
InChIKey	CYKFTBYSTDEZTL-QXMHVHEDSA-N
XLogP	1.35
TPSA	9.23 Å²
H-Bond Donors
H-Bond Acceptors	1
Rotatable Bonds	2
Heavy Atoms	13
Complexity	—

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	174.24
LogP ≤ 5	1.35
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	1

Frequently Asked Questions

What is the IUPAC name of (6E)-6-(1-methoxyprop-2-enylidene)-1-methyl-5-methylidenecyclohexa-1,3-diene?

The IUPAC name of (6E)-6-(1-methoxyprop-2-enylidene)-1-methyl-5-methylidenecyclohexa-1,3-diene (CID 142213123) is (6E)-6-(1-methoxyprop-2-enylidene)-1-methyl-5-methylidenecyclohexa-1,3-diene.

What is the SMILES notation for (6E)-6-(1-methoxyprop-2-enylidene)-1-methyl-5-methylidenecyclohexa-1,3-diene?

The canonical SMILES for (6E)-6-(1-methoxyprop-2-enylidene)-1-methyl-5-methylidenecyclohexa-1,3-diene is C=C/C(OC)=c1/c(C)cccc1=C.

What is the InChIKey of (6E)-6-(1-methoxyprop-2-enylidene)-1-methyl-5-methylidenecyclohexa-1,3-diene?

The InChIKey is CYKFTBYSTDEZTL-QXMHVHEDSA-N. The full InChI is InChI=1S/C12H14O/c1-5-11(13-4)12-9(2)7-6-8-10(12)3/h5-8H,1-2H2,3-4H3/b12-11-.

What are the key properties of (6E)-6-(1-methoxyprop-2-enylidene)-1-methyl-5-methylidenecyclohexa-1,3-diene?

(6E)-6-(1-methoxyprop-2-enylidene)-1-methyl-5-methylidenecyclohexa-1,3-diene has a molecular weight of 174.24 g/mol, XLogP of 1.35, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.

Where does this data come from?

All data for (6E)-6-(1-methoxyprop-2-enylidene)-1-methyl-5-methylidenecyclohexa-1,3-diene is sourced from PubChem (CID 142213123), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

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Sources

PubChem CID 142213123 — identifiers, structure, computed properties (public domain)

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