6-fluoro-8-(2-phenylphenyl)-3,4-dihydro-2H-chromene

C21H17FO — CID 143663684

IUPAC6-fluoro-8-(2-phenylphenyl)-3,4-dihydro-2H-chromene
SMILESFc1cc2c(c(-c3ccccc3-c3ccccc3)c1)OCCC2
InChIInChI=1S/C21H17FO/c22-17-13-16-9-6-12-23-21(16)20(14-17)19-11-5-4-10-18(19)15-7-2-1-3-8-15/h1-5,7-8,10-11,13-14H,6,9,12H2
InChIKeyMDNBLWMBXUTYFR-UHFFFAOYSA-N
MW304.36 g/mol
LogP5.48
Rot. Bonds2

About 6-fluoro-8-(2-phenylphenyl)-3,4-dihydro-2H-chromene

6-fluoro-8-(2-phenylphenyl)-3,4-dihydro-2H-chromene (PubChem CID 143663684) has the molecular formula C21H17FO and a molecular weight of 304.36 g/mol. Its IUPAC name is 6-fluoro-8-(2-phenylphenyl)-3,4-dihydro-2H-chromene.

Molecular Properties

Compound Name6-fluoro-8-(2-phenylphenyl)-3,4-dihydro-2H-chromene
PubChem CID143663684
Molecular FormulaC21H17FO
Molecular Weight304.36 g/mol
Exact Mass304.13
IUPAC Name6-fluoro-8-(2-phenylphenyl)-3,4-dihydro-2H-chromene
SMILESFc1cc2c(c(-c3ccccc3-c3ccccc3)c1)OCCC2
InChIInChI=1S/C21H17FO/c22-17-13-16-9-6-12-23-21(16)20(14-17)19-11-5-4-10-18(19)15-7-2-1-3-8-15/h1-5,7-8,10-11,13-14H,6,9,12H2
InChIKeyMDNBLWMBXUTYFR-UHFFFAOYSA-N
XLogP5.48
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500304.36
LogP ≤ 55.48
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

6-chloro-8-(2-fluorophenyl)-3,4-dihydro-2H-chromene
CID 143663681
6,8-difluoro-3,4-dihydro-2H-chromene
CID 69010256
[(2R)-6-fluoro-8-(2-phenylphenyl)-3,4-dihydro-2H-chromen-2-yl]methanamine;hydrochloride
CID 69117682
6-fluoro-8-(4-methoxy-2-methylphenyl)-3,4-dihydro-2H-chromene
CID 143663719
(6-fluoro-3,4-dihydro-2H-chromen-8-yl)methanol
CID 55252783
3-(6-fluoro-3,4-dihydro-2H-chromen-8-yl)-4-(trifluoromethyl)benzonitrile
CID 143567607
6-fluoro-3,4-dihydro-2H-chromene-8-carbaldehyde
CID 11229132
8-(2-fluorophenyl)-3,4-dihydro-2H-chromene;methanamine
CID 143567573
4-(3,4-dihydro-2H-chromen-8-yl)-2-fluoroaniline
CID 114746433
4-(3,4-dihydro-2H-chromen-8-yl)pyridine
CID 165409197
3-(3,4-dihydro-2H-chromen-8-yl)-4-fluoroaniline
CID 114746463
2-chloro-6-(2,3-dihydro-1-benzofuran-7-yl)-4-fluoroaniline
CID 107616064

Frequently Asked Questions

What is the IUPAC name of 6-fluoro-8-(2-phenylphenyl)-3,4-dihydro-2H-chromene?
The IUPAC name of 6-fluoro-8-(2-phenylphenyl)-3,4-dihydro-2H-chromene (CID 143663684) is 6-fluoro-8-(2-phenylphenyl)-3,4-dihydro-2H-chromene.
What is the SMILES notation for 6-fluoro-8-(2-phenylphenyl)-3,4-dihydro-2H-chromene?
The canonical SMILES for 6-fluoro-8-(2-phenylphenyl)-3,4-dihydro-2H-chromene is Fc1cc2c(c(-c3ccccc3-c3ccccc3)c1)OCCC2.
What is the InChIKey of 6-fluoro-8-(2-phenylphenyl)-3,4-dihydro-2H-chromene?
The InChIKey is MDNBLWMBXUTYFR-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H17FO/c22-17-13-16-9-6-12-23-21(16)20(14-17)19-11-5-4-10-18(19)15-7-2-1-3-8-15/h1-5,7-8,10-11,13-14H,6,9,12H2.
What are the key properties of 6-fluoro-8-(2-phenylphenyl)-3,4-dihydro-2H-chromene?
6-fluoro-8-(2-phenylphenyl)-3,4-dihydro-2H-chromene has a molecular weight of 304.36 g/mol, XLogP of 5.48, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6-fluoro-8-(2-phenylphenyl)-3,4-dihydro-2H-chromene is sourced from PubChem (CID 143663684), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).