(5E)-5-(2-methoxyethylidene)-4-methyl-2H-furan

C8H12O2 — CID 135049914

IUPAC(5E)-5-(2-methoxyethylidene)-4-methyl-2H-furan
SMILESCOC/C=C1/OCC=C1C
InChIInChI=1S/C8H12O2/c1-7-3-6-10-8(7)4-5-9-2/h3-4H,5-6H2,1-2H3/b8-4+
InChIKeyJOUCLAGNXBXBTP-XBXARRHUSA-N
MW140.18 g/mol
LogP1.49
Rot. Bonds2

About (5E)-5-(2-methoxyethylidene)-4-methyl-2H-furan

(5E)-5-(2-methoxyethylidene)-4-methyl-2H-furan (PubChem CID 135049914) has the molecular formula C8H12O2 and a molecular weight of 140.18 g/mol. Its IUPAC name is (5E)-5-(2-methoxyethylidene)-4-methyl-2H-furan.

Molecular Properties

Compound Name(5E)-5-(2-methoxyethylidene)-4-methyl-2H-furan
PubChem CID135049914
Molecular FormulaC8H12O2
Molecular Weight140.18 g/mol
Exact Mass140.08
IUPAC Name(5E)-5-(2-methoxyethylidene)-4-methyl-2H-furan
SMILESCOC/C=C1/OCC=C1C
InChIInChI=1S/C8H12O2/c1-7-3-6-10-8(7)4-5-9-2/h3-4H,5-6H2,1-2H3/b8-4+
InChIKeyJOUCLAGNXBXBTP-XBXARRHUSA-N
XLogP1.49
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms10
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500140.18
LogP ≤ 51.49
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (5E)-5-(2-methoxyethylidene)-4-methyl-2H-furan?
The IUPAC name of (5E)-5-(2-methoxyethylidene)-4-methyl-2H-furan (CID 135049914) is (5E)-5-(2-methoxyethylidene)-4-methyl-2H-furan.
What is the SMILES notation for (5E)-5-(2-methoxyethylidene)-4-methyl-2H-furan?
The canonical SMILES for (5E)-5-(2-methoxyethylidene)-4-methyl-2H-furan is COC/C=C1/OCC=C1C.
What is the InChIKey of (5E)-5-(2-methoxyethylidene)-4-methyl-2H-furan?
The InChIKey is JOUCLAGNXBXBTP-XBXARRHUSA-N. The full InChI is InChI=1S/C8H12O2/c1-7-3-6-10-8(7)4-5-9-2/h3-4H,5-6H2,1-2H3/b8-4+.
What are the key properties of (5E)-5-(2-methoxyethylidene)-4-methyl-2H-furan?
(5E)-5-(2-methoxyethylidene)-4-methyl-2H-furan has a molecular weight of 140.18 g/mol, XLogP of 1.49, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (5E)-5-(2-methoxyethylidene)-4-methyl-2H-furan is sourced from PubChem (CID 135049914), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).