6-ethenyl-3,4-dihydro-2H-chromene

C11H12O — CID 23503811

IUPAC6-ethenyl-3,4-dihydro-2H-chromene
SMILESC=Cc1ccc2c(c1)CCCO2
InChIInChI=1S/C11H12O/c1-2-9-5-6-11-10(8-9)4-3-7-12-11/h2,5-6,8H,1,3-4,7H2
InChIKeyYACCNKUYPZXRCB-UHFFFAOYSA-N
MW160.22 g/mol
LogP2.65
Rot. Bonds1

About 6-ethenyl-3,4-dihydro-2H-chromene

6-ethenyl-3,4-dihydro-2H-chromene (PubChem CID 23503811) has the molecular formula C11H12O and a molecular weight of 160.22 g/mol. Its IUPAC name is 6-ethenyl-3,4-dihydro-2H-chromene.

Molecular Properties

Compound Name6-ethenyl-3,4-dihydro-2H-chromene
PubChem CID23503811
Molecular FormulaC11H12O
Molecular Weight160.22 g/mol
Exact Mass160.09
IUPAC Name6-ethenyl-3,4-dihydro-2H-chromene
SMILESC=Cc1ccc2c(c1)CCCO2
InChIInChI=1S/C11H12O/c1-2-9-5-6-11-10(8-9)4-3-7-12-11/h2,5-6,8H,1,3-4,7H2
InChIKeyYACCNKUYPZXRCB-UHFFFAOYSA-N
XLogP2.65
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms12
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500160.22
LogP ≤ 52.65
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 6-ethenyl-3,4-dihydro-2H-chromene?
The IUPAC name of 6-ethenyl-3,4-dihydro-2H-chromene (CID 23503811) is 6-ethenyl-3,4-dihydro-2H-chromene.
What is the SMILES notation for 6-ethenyl-3,4-dihydro-2H-chromene?
The canonical SMILES for 6-ethenyl-3,4-dihydro-2H-chromene is C=Cc1ccc2c(c1)CCCO2.
What is the InChIKey of 6-ethenyl-3,4-dihydro-2H-chromene?
The InChIKey is YACCNKUYPZXRCB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12O/c1-2-9-5-6-11-10(8-9)4-3-7-12-11/h2,5-6,8H,1,3-4,7H2.
What are the key properties of 6-ethenyl-3,4-dihydro-2H-chromene?
6-ethenyl-3,4-dihydro-2H-chromene has a molecular weight of 160.22 g/mol, XLogP of 2.65, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6-ethenyl-3,4-dihydro-2H-chromene is sourced from PubChem (CID 23503811), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).