4-methoxy-6-methylidenecyclohexa-2,4-dien-1-ol

C8H10O2 — CID 21257311

IUPAC4-methoxy-6-methylidenecyclohexa-2,4-dien-1-ol
SMILESC=C1C=C(OC)C=CC1O
InChIInChI=1S/C8H10O2/c1-6-5-7(10-2)3-4-8(6)9/h3-5,8-9H,1H2,2H3
InChIKeyKHZIOIZTQQPRLG-UHFFFAOYSA-N
MW138.17 g/mol
LogP1.00
Rot. Bonds1

About 4-methoxy-6-methylidenecyclohexa-2,4-dien-1-ol

4-methoxy-6-methylidenecyclohexa-2,4-dien-1-ol (PubChem CID 21257311) has the molecular formula C8H10O2 and a molecular weight of 138.17 g/mol. Its IUPAC name is 4-methoxy-6-methylidenecyclohexa-2,4-dien-1-ol.

Molecular Properties

Compound Name4-methoxy-6-methylidenecyclohexa-2,4-dien-1-ol
PubChem CID21257311
Molecular FormulaC8H10O2
Molecular Weight138.17 g/mol
Exact Mass138.07
IUPAC Name4-methoxy-6-methylidenecyclohexa-2,4-dien-1-ol
SMILESC=C1C=C(OC)C=CC1O
InChIInChI=1S/C8H10O2/c1-6-5-7(10-2)3-4-8(6)9/h3-5,8-9H,1H2,2H3
InChIKeyKHZIOIZTQQPRLG-UHFFFAOYSA-N
XLogP1.00
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500138.17
LogP ≤ 51.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-methoxy-6-methylidenecyclohexa-2,4-dien-1-ol?
The IUPAC name of 4-methoxy-6-methylidenecyclohexa-2,4-dien-1-ol (CID 21257311) is 4-methoxy-6-methylidenecyclohexa-2,4-dien-1-ol.
What is the SMILES notation for 4-methoxy-6-methylidenecyclohexa-2,4-dien-1-ol?
The canonical SMILES for 4-methoxy-6-methylidenecyclohexa-2,4-dien-1-ol is C=C1C=C(OC)C=CC1O.
What is the InChIKey of 4-methoxy-6-methylidenecyclohexa-2,4-dien-1-ol?
The InChIKey is KHZIOIZTQQPRLG-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10O2/c1-6-5-7(10-2)3-4-8(6)9/h3-5,8-9H,1H2,2H3.
What are the key properties of 4-methoxy-6-methylidenecyclohexa-2,4-dien-1-ol?
4-methoxy-6-methylidenecyclohexa-2,4-dien-1-ol has a molecular weight of 138.17 g/mol, XLogP of 1.00, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-6-methylidenecyclohexa-2,4-dien-1-ol is sourced from PubChem (CID 21257311), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).