(3E)-3-[(2-methoxyphenyl)methylidene]oxolane

C12H14O2 — CID 166284999

IUPAC(3E)-3-[(2-methoxyphenyl)methylidene]oxolane
SMILESCOc1ccccc1/C=C1\CCOC1
InChIInChI=1S/C12H14O2/c1-13-12-5-3-2-4-11(12)8-10-6-7-14-9-10/h2-5,8H,6-7,9H2,1H3/b10-8+
InChIKeyVZQYKACJNZFFAF-CSKARUKUSA-N
MW190.24 g/mol
LogP2.50
Rot. Bonds2

About (3E)-3-[(2-methoxyphenyl)methylidene]oxolane

(3E)-3-[(2-methoxyphenyl)methylidene]oxolane (PubChem CID 166284999) has the molecular formula C12H14O2 and a molecular weight of 190.24 g/mol. Its IUPAC name is (3E)-3-[(2-methoxyphenyl)methylidene]oxolane.

Molecular Properties

Compound Name(3E)-3-[(2-methoxyphenyl)methylidene]oxolane
PubChem CID166284999
Molecular FormulaC12H14O2
Molecular Weight190.24 g/mol
Exact Mass190.10
IUPAC Name(3E)-3-[(2-methoxyphenyl)methylidene]oxolane
SMILESCOc1ccccc1/C=C1\CCOC1
InChIInChI=1S/C12H14O2/c1-13-12-5-3-2-4-11(12)8-10-6-7-14-9-10/h2-5,8H,6-7,9H2,1H3/b10-8+
InChIKeyVZQYKACJNZFFAF-CSKARUKUSA-N
XLogP2.50
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.24
LogP ≤ 52.50
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

(3E,5E)-3,5-bis[(2-methoxyphenyl)methylidene]oxan-4-one
CID 121461091
(2R)-2-[(E)-2-(2-methoxyphenyl)ethenyl]oxirane
CID 24806595
1-(2-fluoroethenyl)-2-methoxybenzene
CID 134862998
(3E)-3-[(2-methoxyphenyl)methylidene]oxolane-2,5-dione
CID 82158591
1-[(E)-3,3-dimethylbut-1-enyl]-2-methoxybenzene
CID 10375267
1-[(1E,3E)-4-bromobuta-1,3-dienyl]-2-methoxybenzene
CID 177481549
(4Z)-4-[(2-methoxyphenyl)methylidene]-2-(oxan-4-yl)-1,3-oxazol-5-one
CID 108936245
(2Z)-2-[(2-methoxyphenyl)methylidene]-3,4-dihydronaphthalen-1-one
CID 6925418
1-[(Z)-but-1-en-3-ynyl]-2-methoxybenzene
CID 101454331
[2-(2-methoxyphenyl)-1-trimethylsilylethenyl]-trimethylsilane
CID 102296582
(E)-3-(2-methoxyphenyl)prop-2-en-1-ol
CID 11400969
(2Z)-2-[(2-methoxyphenoxy)methylidene]oxirane
CID 148851694

Frequently Asked Questions

What is the IUPAC name of (3E)-3-[(2-methoxyphenyl)methylidene]oxolane?
The IUPAC name of (3E)-3-[(2-methoxyphenyl)methylidene]oxolane (CID 166284999) is (3E)-3-[(2-methoxyphenyl)methylidene]oxolane.
What is the SMILES notation for (3E)-3-[(2-methoxyphenyl)methylidene]oxolane?
The canonical SMILES for (3E)-3-[(2-methoxyphenyl)methylidene]oxolane is COc1ccccc1/C=C1\CCOC1.
What is the InChIKey of (3E)-3-[(2-methoxyphenyl)methylidene]oxolane?
The InChIKey is VZQYKACJNZFFAF-CSKARUKUSA-N. The full InChI is InChI=1S/C12H14O2/c1-13-12-5-3-2-4-11(12)8-10-6-7-14-9-10/h2-5,8H,6-7,9H2,1H3/b10-8+.
What are the key properties of (3E)-3-[(2-methoxyphenyl)methylidene]oxolane?
(3E)-3-[(2-methoxyphenyl)methylidene]oxolane has a molecular weight of 190.24 g/mol, XLogP of 2.50, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3E)-3-[(2-methoxyphenyl)methylidene]oxolane is sourced from PubChem (CID 166284999), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).