8-prop-1-enylchromen-4-one

C12H10O2 — CID 139947764

IUPAC8-prop-1-enylchromen-4-one
SMILESCC=Cc1cccc2c(=O)ccoc12
InChIInChI=1S/C12H10O2/c1-2-4-9-5-3-6-10-11(13)7-8-14-12(9)10/h2-8H,1H3
InChIKeyOTGOGBQVXPGUIO-UHFFFAOYSA-N
MW186.21 g/mol
LogP2.83
Rot. Bonds1

About 8-prop-1-enylchromen-4-one

8-prop-1-enylchromen-4-one (PubChem CID 139947764) has the molecular formula C12H10O2 and a molecular weight of 186.21 g/mol. Its IUPAC name is 8-prop-1-enylchromen-4-one.

Molecular Properties

Compound Name8-prop-1-enylchromen-4-one
PubChem CID139947764
Molecular FormulaC12H10O2
Molecular Weight186.21 g/mol
Exact Mass186.07
IUPAC Name8-prop-1-enylchromen-4-one
SMILESCC=Cc1cccc2c(=O)ccoc12
InChIInChI=1S/C12H10O2/c1-2-4-9-5-3-6-10-11(13)7-8-14-12(9)10/h2-8H,1H3
InChIKeyOTGOGBQVXPGUIO-UHFFFAOYSA-N
XLogP2.83
TPSA30.21 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.21
LogP ≤ 52.83
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 8-prop-1-enylchromen-4-one?
The IUPAC name of 8-prop-1-enylchromen-4-one (CID 139947764) is 8-prop-1-enylchromen-4-one.
What is the SMILES notation for 8-prop-1-enylchromen-4-one?
The canonical SMILES for 8-prop-1-enylchromen-4-one is CC=Cc1cccc2c(=O)ccoc12.
What is the InChIKey of 8-prop-1-enylchromen-4-one?
The InChIKey is OTGOGBQVXPGUIO-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10O2/c1-2-4-9-5-3-6-10-11(13)7-8-14-12(9)10/h2-8H,1H3.
What are the key properties of 8-prop-1-enylchromen-4-one?
8-prop-1-enylchromen-4-one has a molecular weight of 186.21 g/mol, XLogP of 2.83, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 8-prop-1-enylchromen-4-one is sourced from PubChem (CID 139947764), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).