2-chloro-1-(3,5-diphenylphenyl)dibenzofuran

C30H19ClO — CID 177281427

IUPAC2-chloro-1-(3,5-diphenylphenyl)dibenzofuran
SMILESClc1ccc2oc3ccccc3c2c1-c1cc(-c2ccccc2)cc(-c2ccccc2)c1
InChIInChI=1S/C30H19ClO/c31-26-15-16-28-30(25-13-7-8-14-27(25)32-28)29(26)24-18-22(20-9-3-1-4-10-20)17-23(19-24)21-11-5-2-6-12-21/h1-19H
InChIKeyFPGPGSVWFJOUJV-UHFFFAOYSA-N
MW430.93 g/mol
LogP9.24
Rot. Bonds3

About 2-chloro-1-(3,5-diphenylphenyl)dibenzofuran

2-chloro-1-(3,5-diphenylphenyl)dibenzofuran (PubChem CID 177281427) has the molecular formula C30H19ClO and a molecular weight of 430.93 g/mol. Its IUPAC name is 2-chloro-1-(3,5-diphenylphenyl)dibenzofuran.

Molecular Properties

Compound Name2-chloro-1-(3,5-diphenylphenyl)dibenzofuran
PubChem CID177281427
Molecular FormulaC30H19ClO
Molecular Weight430.93 g/mol
Exact Mass430.11
IUPAC Name2-chloro-1-(3,5-diphenylphenyl)dibenzofuran
SMILESClc1ccc2oc3ccccc3c2c1-c1cc(-c2ccccc2)cc(-c2ccccc2)c1
InChIInChI=1S/C30H19ClO/c31-26-15-16-28-30(25-13-7-8-14-27(25)32-28)29(26)24-18-22(20-9-3-1-4-10-20)17-23(19-24)21-11-5-2-6-12-21/h1-19H
InChIKeyFPGPGSVWFJOUJV-UHFFFAOYSA-N
XLogP9.24
TPSA13.14 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms32
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500430.93
LogP ≤ 59.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

2-(3,5-diphenylphenyl)-1-[4-(10-phenylanthracen-9-yl)phenyl]dibenzofuran
CID 134164763
5-[3-(9,14-dioxapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3(8),4,6,11,15,17,19-nonaen-5-yl)phenyl]-18-phenyl-9,14-dioxapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3(8),4,6,11,15(20),16,18-nonaene
CID 118148546
1-[2-[4-[10-(3,5-diphenylphenyl)anthracen-9-yl]phenyl]phenyl]dibenzofuran
CID 174297045
1-[10-(4,5-dichloroanthracen-9-yl)anthracen-9-yl]-2-phenyldibenzofuran
CID 163589465
1-[3,5-bis(3-phenylphenyl)phenyl]dibenzofuran
CID 154618828
9-dibenzofuran-2-yl-10-(3,5-diphenylphenyl)anthracene-1,2,3,4,5,6,7,8-octol
CID 158620166
16-[10-(4-phenylphenyl)anthracen-9-yl]-9,20-dioxapentacyclo[11.7.0.02,10.03,8.014,19]icosa-1(13),2(10),3,5,7,11,14(19),15,17-nonaene
CID 122426254
4-phenyl-N-[4-[4-[2-(1-phenyldibenzofuran-2-yl)dibenzofuran-1-yl]phenyl]phenyl]-N-(4-phenylphenyl)aniline
CID 138481521
3-phenyl-1-[10-(4-phenylphenyl)anthracen-9-yl]dibenzofuran
CID 170249878
2-[3-(9,10-diphenylanthracen-2-yl)-5-(3-phenylphenyl)phenyl]dibenzofuran
CID 58261864
15-chloro-2-phenyl-10,20-dioxapentacyclo[11.7.0.03,11.04,9.014,19]icosa-1,3(11),4,6,8,12,14(19),15,17-nonaene
CID 154727808
8-[10-(3,5-diphenylphenyl)anthracen-9-yl]-1-(10-phenylanthracen-9-yl)dibenzofuran
CID 177089190

Frequently Asked Questions

What is the IUPAC name of 2-chloro-1-(3,5-diphenylphenyl)dibenzofuran?
The IUPAC name of 2-chloro-1-(3,5-diphenylphenyl)dibenzofuran (CID 177281427) is 2-chloro-1-(3,5-diphenylphenyl)dibenzofuran.
What is the SMILES notation for 2-chloro-1-(3,5-diphenylphenyl)dibenzofuran?
The canonical SMILES for 2-chloro-1-(3,5-diphenylphenyl)dibenzofuran is Clc1ccc2oc3ccccc3c2c1-c1cc(-c2ccccc2)cc(-c2ccccc2)c1.
What is the InChIKey of 2-chloro-1-(3,5-diphenylphenyl)dibenzofuran?
The InChIKey is FPGPGSVWFJOUJV-UHFFFAOYSA-N. The full InChI is InChI=1S/C30H19ClO/c31-26-15-16-28-30(25-13-7-8-14-27(25)32-28)29(26)24-18-22(20-9-3-1-4-10-20)17-23(19-24)21-11-5-2-6-12-21/h1-19H.
What are the key properties of 2-chloro-1-(3,5-diphenylphenyl)dibenzofuran?
2-chloro-1-(3,5-diphenylphenyl)dibenzofuran has a molecular weight of 430.93 g/mol, XLogP of 9.24, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-1-(3,5-diphenylphenyl)dibenzofuran is sourced from PubChem (CID 177281427), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).