4-(4-methylphenyl)-2-phenyl-2,3-dihydrobenzo[g][1]benzofuran

C25H20O — CID 132575879

IUPAC4-(4-methylphenyl)-2-phenyl-2,3-dihydrobenzo[g][1]benzofuran
SMILESCc1ccc(-c2cc3ccccc3c3c2CC(c2ccccc2)O3)cc1
InChIInChI=1S/C25H20O/c1-17-11-13-18(14-12-17)22-15-20-9-5-6-10-21(20)25-23(22)16-24(26-25)19-7-3-2-4-8-19/h2-15,24H,16H2,1H3
InChIKeyIWPPJWXRDDCDCK-UHFFFAOYSA-N
MW336.43 g/mol
LogP6.49
Rot. Bonds2

About 4-(4-methylphenyl)-2-phenyl-2,3-dihydrobenzo[g][1]benzofuran

4-(4-methylphenyl)-2-phenyl-2,3-dihydrobenzo[g][1]benzofuran (PubChem CID 132575879) has the molecular formula C25H20O and a molecular weight of 336.43 g/mol. Its IUPAC name is 4-(4-methylphenyl)-2-phenyl-2,3-dihydrobenzo[g][1]benzofuran.

Molecular Properties

Compound Name4-(4-methylphenyl)-2-phenyl-2,3-dihydrobenzo[g][1]benzofuran
PubChem CID132575879
Molecular FormulaC25H20O
Molecular Weight336.43 g/mol
Exact Mass336.15
IUPAC Name4-(4-methylphenyl)-2-phenyl-2,3-dihydrobenzo[g][1]benzofuran
SMILESCc1ccc(-c2cc3ccccc3c3c2CC(c2ccccc2)O3)cc1
InChIInChI=1S/C25H20O/c1-17-11-13-18(14-12-17)22-15-20-9-5-6-10-21(20)25-23(22)16-24(26-25)19-7-3-2-4-8-19/h2-15,24H,16H2,1H3
InChIKeyIWPPJWXRDDCDCK-UHFFFAOYSA-N
XLogP6.49
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500336.43
LogP ≤ 56.49
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

2-(3,4-dimethoxyphenyl)-4-phenyl-2,3-dihydrobenzo[g][1]benzofuran
CID 132575889
2-phenyl-2,3-dihydrobenzo[g][1]benzofuran
CID 102323760
2,4-diphenyl-2,3-dihydrofuro[3,2-c]quinoline
CID 164677448
2-(3-methylphenyl)-4,6-diphenyl-2,3-dihydrofuro[2,3-b]pyridine
CID 141482782
3-(4-methylphenyl)-1,2-diphenylnaphthalene
CID 178068265
9-[2-(4-methylphenyl)phenyl]phenanthrene
CID 140958639
13-hydroxy-10,16-bis(4-methylphenyl)-12,14-dioxa-13λ5-phosphapentacyclo[13.8.0.02,11.03,8.018,23]tricosa-1(15),2(11),3,5,7,9,16,18,20,22-decaene 13-oxide
CID 23110717
[(13R,17S)-10,20-diphenyl-15-hexacyclo[17.8.0.02,11.03,8.013,17.022,27]heptacosa-1(19),2(11),3,5,7,9,20,22,24,26-decaenyl]-trimethylsilane
CID 164672219
2-(4-methylphenyl)-2,3-dihydrochromen-4-one
CID 2802466
4-[(1R,2S)-2-(4-methylphenyl)cyclopropyl]-2,3-dihydrobenzo[g][1]benzofuran
CID 166443823
1-chloro-2-(4-methylphenyl)selanyl-3-phenylnaphthalene
CID 62706569
(NE,S)-2-methyl-N-[(2R)-2-phenyl-2,3-dihydrobenzo[g]chromen-4-ylidene]propane-2-sulfinamide
CID 178178473

Frequently Asked Questions

What is the IUPAC name of 4-(4-methylphenyl)-2-phenyl-2,3-dihydrobenzo[g][1]benzofuran?
The IUPAC name of 4-(4-methylphenyl)-2-phenyl-2,3-dihydrobenzo[g][1]benzofuran (CID 132575879) is 4-(4-methylphenyl)-2-phenyl-2,3-dihydrobenzo[g][1]benzofuran.
What is the SMILES notation for 4-(4-methylphenyl)-2-phenyl-2,3-dihydrobenzo[g][1]benzofuran?
The canonical SMILES for 4-(4-methylphenyl)-2-phenyl-2,3-dihydrobenzo[g][1]benzofuran is Cc1ccc(-c2cc3ccccc3c3c2CC(c2ccccc2)O3)cc1.
What is the InChIKey of 4-(4-methylphenyl)-2-phenyl-2,3-dihydrobenzo[g][1]benzofuran?
The InChIKey is IWPPJWXRDDCDCK-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H20O/c1-17-11-13-18(14-12-17)22-15-20-9-5-6-10-21(20)25-23(22)16-24(26-25)19-7-3-2-4-8-19/h2-15,24H,16H2,1H3.
What are the key properties of 4-(4-methylphenyl)-2-phenyl-2,3-dihydrobenzo[g][1]benzofuran?
4-(4-methylphenyl)-2-phenyl-2,3-dihydrobenzo[g][1]benzofuran has a molecular weight of 336.43 g/mol, XLogP of 6.49, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-methylphenyl)-2-phenyl-2,3-dihydrobenzo[g][1]benzofuran is sourced from PubChem (CID 132575879), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).