3-phenyl-3,4-dihydro-2H-chromene

C15H14O — CID 500472

IUPAC3-phenyl-3,4-dihydro-2H-chromene
SMILESc1ccc(C2COc3ccccc3C2)cc1
InChIInChI=1S/C15H14O/c1-2-6-12(7-3-1)14-10-13-8-4-5-9-15(13)16-11-14/h1-9,14H,10-11H2
InChIKeyNNQSGBRGJHSRFN-UHFFFAOYSA-N
MW210.28 g/mol
LogP3.41
Rot. Bonds1

About 3-phenyl-3,4-dihydro-2H-chromene

3-phenyl-3,4-dihydro-2H-chromene (PubChem CID 500472) has the molecular formula C15H14O and a molecular weight of 210.28 g/mol. Its IUPAC name is 3-phenyl-3,4-dihydro-2H-chromene.

Molecular Properties

Compound Name3-phenyl-3,4-dihydro-2H-chromene
PubChem CID500472
Molecular FormulaC15H14O
Molecular Weight210.28 g/mol
Exact Mass210.10
IUPAC Name3-phenyl-3,4-dihydro-2H-chromene
SMILESc1ccc(C2COc3ccccc3C2)cc1
InChIInChI=1S/C15H14O/c1-2-6-12(7-3-1)14-10-13-8-4-5-9-15(13)16-11-14/h1-9,14H,10-11H2
InChIKeyNNQSGBRGJHSRFN-UHFFFAOYSA-N
XLogP3.41
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.28
LogP ≤ 53.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 3-phenyl-3,4-dihydro-2H-chromene?
The IUPAC name of 3-phenyl-3,4-dihydro-2H-chromene (CID 500472) is 3-phenyl-3,4-dihydro-2H-chromene.
What is the SMILES notation for 3-phenyl-3,4-dihydro-2H-chromene?
The canonical SMILES for 3-phenyl-3,4-dihydro-2H-chromene is c1ccc(C2COc3ccccc3C2)cc1.
What is the InChIKey of 3-phenyl-3,4-dihydro-2H-chromene?
The InChIKey is NNQSGBRGJHSRFN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14O/c1-2-6-12(7-3-1)14-10-13-8-4-5-9-15(13)16-11-14/h1-9,14H,10-11H2.
What are the key properties of 3-phenyl-3,4-dihydro-2H-chromene?
3-phenyl-3,4-dihydro-2H-chromene has a molecular weight of 210.28 g/mol, XLogP of 3.41, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-phenyl-3,4-dihydro-2H-chromene is sourced from PubChem (CID 500472), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).