5-methyl-2,2-diphenylbenzo[h]chromene

C26H20O — CID 23371123

IUPAC5-methyl-2,2-diphenylbenzo[h]chromene
SMILESCc1cc2ccccc2c2c1C=CC(c1ccccc1)(c1ccccc1)O2
InChIInChI=1S/C26H20O/c1-19-18-20-10-8-9-15-24(20)25-23(19)16-17-26(27-25,21-11-4-2-5-12-21)22-13-6-3-7-14-22/h2-18H,1H3
InChIKeyZEOZTSCEGPVRMI-UHFFFAOYSA-N
MW348.45 g/mol
LogP6.50
Rot. Bonds2

About 5-methyl-2,2-diphenylbenzo[h]chromene

5-methyl-2,2-diphenylbenzo[h]chromene (PubChem CID 23371123) has the molecular formula C26H20O and a molecular weight of 348.45 g/mol. Its IUPAC name is 5-methyl-2,2-diphenylbenzo[h]chromene.

Molecular Properties

Compound Name5-methyl-2,2-diphenylbenzo[h]chromene
PubChem CID23371123
Molecular FormulaC26H20O
Molecular Weight348.45 g/mol
Exact Mass348.15
IUPAC Name5-methyl-2,2-diphenylbenzo[h]chromene
SMILESCc1cc2ccccc2c2c1C=CC(c1ccccc1)(c1ccccc1)O2
InChIInChI=1S/C26H20O/c1-19-18-20-10-8-9-15-24(20)25-23(19)16-17-26(27-25,21-11-4-2-5-12-21)22-13-6-3-7-14-22/h2-18H,1H3
InChIKeyZEOZTSCEGPVRMI-UHFFFAOYSA-N
XLogP6.50
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500348.45
LogP ≤ 56.50
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

2,2,5-triphenylbenzo[h]chromene
CID 13007765
methyl 11-methyl-3,3-diphenylnaphtho[1,2-h]chromene-12-carboxylate
CID 22412475
(3,3-diphenylbenzo[f]chromen-5-yl) trifluoromethanesulfonate
CID 10983702
4,4,17,17-tetrakis(4-methoxyphenyl)-3,18-dioxatetracyclo[12.4.0.02,7.08,13]octadeca-1(14),2(7),5,8,10,12,15-heptaene
CID 4316919
tert-butyl N-(3,3-diphenylbenzo[f]chromen-5-yl)carbamate
CID 132609095
N-[(3,3-diphenylbenzo[f]chromen-5-yl)methyl]-2-ethoxy-N-(2-ethoxyethyl)ethanamine
CID 11813174
[3-(2-fluorophenyl)-3-phenylbenzo[f]chromen-5-yl]methanol
CID 69314165
(3S)-3-(3,4-dimethoxyphenyl)-3-phenylbenzo[f]chromene
CID 102063385
N,N-diphenyl-4-(2-phenylbenzo[h]chromen-2-yl)aniline
CID 70344376
ethyl 2,2,5-triphenylbenzo[h]chromene-6-carboxylate
CID 18316931
18,21,21-trimethyl-5-phenyl-5-(4-phenylphenyl)-6-oxapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(14),2(7),3,8,10,12,15(20),16,18-nonaene
CID 170015510
ethane;5-methyl-6-[(4-methylphenyl)methyl]-3,3-diphenylbenzo[f]chromene
CID 123566536

Frequently Asked Questions

What is the IUPAC name of 5-methyl-2,2-diphenylbenzo[h]chromene?
The IUPAC name of 5-methyl-2,2-diphenylbenzo[h]chromene (CID 23371123) is 5-methyl-2,2-diphenylbenzo[h]chromene.
What is the SMILES notation for 5-methyl-2,2-diphenylbenzo[h]chromene?
The canonical SMILES for 5-methyl-2,2-diphenylbenzo[h]chromene is Cc1cc2ccccc2c2c1C=CC(c1ccccc1)(c1ccccc1)O2.
What is the InChIKey of 5-methyl-2,2-diphenylbenzo[h]chromene?
The InChIKey is ZEOZTSCEGPVRMI-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H20O/c1-19-18-20-10-8-9-15-24(20)25-23(19)16-17-26(27-25,21-11-4-2-5-12-21)22-13-6-3-7-14-22/h2-18H,1H3.
What are the key properties of 5-methyl-2,2-diphenylbenzo[h]chromene?
5-methyl-2,2-diphenylbenzo[h]chromene has a molecular weight of 348.45 g/mol, XLogP of 6.50, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-2,2-diphenylbenzo[h]chromene is sourced from PubChem (CID 23371123), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).