7-phenylchromen-4-one

C15H10O2 — CID 57034493

IUPAC7-phenylchromen-4-one
SMILESO=c1ccoc2cc(-c3ccccc3)ccc12
InChIInChI=1S/C15H10O2/c16-14-8-9-17-15-10-12(6-7-13(14)15)11-4-2-1-3-5-11/h1-10H
InChIKeyPEJZSLHNXKRZFC-UHFFFAOYSA-N
MW222.24 g/mol
LogP3.46
Rot. Bonds1

About 7-phenylchromen-4-one

7-phenylchromen-4-one (PubChem CID 57034493) has the molecular formula C15H10O2 and a molecular weight of 222.24 g/mol. Its IUPAC name is 7-phenylchromen-4-one.

Molecular Properties

Compound Name7-phenylchromen-4-one
PubChem CID57034493
Molecular FormulaC15H10O2
Molecular Weight222.24 g/mol
Exact Mass222.07
IUPAC Name7-phenylchromen-4-one
SMILESO=c1ccoc2cc(-c3ccccc3)ccc12
InChIInChI=1S/C15H10O2/c16-14-8-9-17-15-10-12(6-7-13(14)15)11-4-2-1-3-5-11/h1-10H
InChIKeyPEJZSLHNXKRZFC-UHFFFAOYSA-N
XLogP3.46
TPSA30.21 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.24
LogP ≤ 53.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 7-phenylchromen-4-one?
The IUPAC name of 7-phenylchromen-4-one (CID 57034493) is 7-phenylchromen-4-one.
What is the SMILES notation for 7-phenylchromen-4-one?
The canonical SMILES for 7-phenylchromen-4-one is O=c1ccoc2cc(-c3ccccc3)ccc12.
What is the InChIKey of 7-phenylchromen-4-one?
The InChIKey is PEJZSLHNXKRZFC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H10O2/c16-14-8-9-17-15-10-12(6-7-13(14)15)11-4-2-1-3-5-11/h1-10H.
What are the key properties of 7-phenylchromen-4-one?
7-phenylchromen-4-one has a molecular weight of 222.24 g/mol, XLogP of 3.46, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-phenylchromen-4-one is sourced from PubChem (CID 57034493), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).