2,6-dimethyl-2,4-diphenylchromene

C23H20O — CID 132534957

IUPAC2,6-dimethyl-2,4-diphenylchromene
SMILESCc1ccc2c(c1)C(c1ccccc1)=CC(C)(c1ccccc1)O2
InChIInChI=1S/C23H20O/c1-17-13-14-22-20(15-17)21(18-9-5-3-6-10-18)16-23(2,24-22)19-11-7-4-8-12-19/h3-16H,1-2H3
InChIKeyKCAGRNASUZIAAK-UHFFFAOYSA-N
MW312.41 g/mol
LogP5.73
Rot. Bonds2

About 2,6-dimethyl-2,4-diphenylchromene

2,6-dimethyl-2,4-diphenylchromene (PubChem CID 132534957) has the molecular formula C23H20O and a molecular weight of 312.41 g/mol. Its IUPAC name is 2,6-dimethyl-2,4-diphenylchromene.

Molecular Properties

Compound Name2,6-dimethyl-2,4-diphenylchromene
PubChem CID132534957
Molecular FormulaC23H20O
Molecular Weight312.41 g/mol
Exact Mass312.15
IUPAC Name2,6-dimethyl-2,4-diphenylchromene
SMILESCc1ccc2c(c1)C(c1ccccc1)=CC(C)(c1ccccc1)O2
InChIInChI=1S/C23H20O/c1-17-13-14-22-20(15-17)21(18-9-5-3-6-10-18)16-23(2,24-22)19-11-7-4-8-12-19/h3-16H,1-2H3
InChIKeyKCAGRNASUZIAAK-UHFFFAOYSA-N
XLogP5.73
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500312.41
LogP ≤ 55.73
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

2-ethyl-2,6-dimethyl-4-phenylchromene
CID 11821502
6-methyl-2,4-diphenyl-2-(2-phenylethynyl)chromene
CID 163364629
6-[1,1-bis(2,2,4-triphenylchromen-6-yl)ethyl]-2,2,4-triphenylchromene
CID 138498468
2,2,4,6-tetramethylchromene
CID 22447422
3,8-dimethyl-5,6-diphenylbenzo[b][1]benzoxepine
CID 13167351
4,6-dimethyl-4-phenyl-1,3-benzodioxin-2-one
CID 86245402
2,6-difluoro-N-[4-(2,2,6-trimethylchromen-4-yl)phenyl]benzamide
CID 87056899
5-(4-methylphenyl)-3,5-diphenylfuran-2-one
CID 12559993
6'-methoxy-6-methyl-3,3'-diphenyl-1,1'-spirobi[indene]
CID 118316397
N-(diaminomethylidene)-2,2-dimethyl-4-phenylchromene-6-carboxamide
CID 58406678
(2S)-6-tert-butyl-4-(4-chlorophenyl)-2-ethoxy-2-phenylchromene
CID 139090498
1-methyl-1,3-diphenylindene
CID 11977257

Frequently Asked Questions

What is the IUPAC name of 2,6-dimethyl-2,4-diphenylchromene?
The IUPAC name of 2,6-dimethyl-2,4-diphenylchromene (CID 132534957) is 2,6-dimethyl-2,4-diphenylchromene.
What is the SMILES notation for 2,6-dimethyl-2,4-diphenylchromene?
The canonical SMILES for 2,6-dimethyl-2,4-diphenylchromene is Cc1ccc2c(c1)C(c1ccccc1)=CC(C)(c1ccccc1)O2.
What is the InChIKey of 2,6-dimethyl-2,4-diphenylchromene?
The InChIKey is KCAGRNASUZIAAK-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H20O/c1-17-13-14-22-20(15-17)21(18-9-5-3-6-10-18)16-23(2,24-22)19-11-7-4-8-12-19/h3-16H,1-2H3.
What are the key properties of 2,6-dimethyl-2,4-diphenylchromene?
2,6-dimethyl-2,4-diphenylchromene has a molecular weight of 312.41 g/mol, XLogP of 5.73, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-dimethyl-2,4-diphenylchromene is sourced from PubChem (CID 132534957), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).