7-chloro-5-dibenzofuran-4-ylnaphtho[1,2-b][1]benzofuran

C28H15ClO2 — CID 167440876

IUPAC7-chloro-5-dibenzofuran-4-ylnaphtho[1,2-b][1]benzofuran
SMILESClc1cccc2oc3c4ccccc4c(-c4cccc5c4oc4ccccc45)cc3c12
InChIInChI=1S/C28H15ClO2/c29-23-12-6-14-25-26(23)22-15-21(16-7-1-2-9-18(16)28(22)31-25)20-11-5-10-19-17-8-3-4-13-24(17)30-27(19)20/h1-15H
InChIKeyBNHCTLBDKPQIHQ-UHFFFAOYSA-N
MW418.88 g/mol
LogP8.96
Rot. Bonds1

About 7-chloro-5-dibenzofuran-4-ylnaphtho[1,2-b][1]benzofuran

7-chloro-5-dibenzofuran-4-ylnaphtho[1,2-b][1]benzofuran (PubChem CID 167440876) has the molecular formula C28H15ClO2 and a molecular weight of 418.88 g/mol. Its IUPAC name is 7-chloro-5-dibenzofuran-4-ylnaphtho[1,2-b][1]benzofuran.

Molecular Properties

Compound Name7-chloro-5-dibenzofuran-4-ylnaphtho[1,2-b][1]benzofuran
PubChem CID167440876
Molecular FormulaC28H15ClO2
Molecular Weight418.88 g/mol
Exact Mass418.08
IUPAC Name7-chloro-5-dibenzofuran-4-ylnaphtho[1,2-b][1]benzofuran
SMILESClc1cccc2oc3c4ccccc4c(-c4cccc5c4oc4ccccc45)cc3c12
InChIInChI=1S/C28H15ClO2/c29-23-12-6-14-25-26(23)22-15-21(16-7-1-2-9-18(16)28(22)31-25)20-11-5-10-19-17-8-3-4-13-24(17)30-27(19)20/h1-15H
InChIKeyBNHCTLBDKPQIHQ-UHFFFAOYSA-N
XLogP8.96
TPSA26.28 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms31
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500418.88
LogP ≤ 58.96
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1-chloro-4-dibenzofuran-4-yl-6,8-diphenyldibenzofuran
CID 139479644
N-[4-(7-chloronaphtho[1,2-b][1]benzofuran-5-yl)phenyl]-N,4-diphenylaniline
CID 167190989
5-chloronaphtho[1,2-b][1]benzofuran
CID 163580167
4-(3-undecacyclo[30.16.0.02,7.08,25.010,23.011,16.017,22.026,31.034,47.035,40.041,46]octatetraconta-1(32),2,4,6,8(25),9,11,13,15,17,19,21,23,26,28,30,33,35,37,39,41,43,45,47-tetracosaenyl)dibenzofuran
CID 134429033
2-chloro-5-dibenzofuran-4-ylaniline
CID 166567147
4-[3-(4-chlorophenyl)naphthalen-1-yl]dibenzofuran
CID 167454705
2-dibenzofuran-1-yl-4-dibenzofuran-4-yl-6-(5-phenylnaphtho[1,2-b][1]benzofuran-7-yl)-1,3,5-triazine
CID 176844516
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
1-chloro-6-[10-(8-chlorodibenzofuran-3-yl)anthracen-9-yl]dibenzofuran
CID 175332614
4-bromo-6-dibenzofuran-4-yldibenzofuran
CID 147905511
4-[4-(5-dibenzofuran-4-ylnaphtho[1,2-b][1]benzofuran-7-yl)phenyl]-2-phenyl-6-(3-phenylphenyl)pyrimidine
CID 164835257
4-[4-(7-dibenzofuran-4-ylnaphtho[1,2-b][1]benzofuran-5-yl)phenyl]-2,6-bis(4-phenylphenyl)pyrimidine
CID 164835215

Frequently Asked Questions

What is the IUPAC name of 7-chloro-5-dibenzofuran-4-ylnaphtho[1,2-b][1]benzofuran?
The IUPAC name of 7-chloro-5-dibenzofuran-4-ylnaphtho[1,2-b][1]benzofuran (CID 167440876) is 7-chloro-5-dibenzofuran-4-ylnaphtho[1,2-b][1]benzofuran.
What is the SMILES notation for 7-chloro-5-dibenzofuran-4-ylnaphtho[1,2-b][1]benzofuran?
The canonical SMILES for 7-chloro-5-dibenzofuran-4-ylnaphtho[1,2-b][1]benzofuran is Clc1cccc2oc3c4ccccc4c(-c4cccc5c4oc4ccccc45)cc3c12.
What is the InChIKey of 7-chloro-5-dibenzofuran-4-ylnaphtho[1,2-b][1]benzofuran?
The InChIKey is BNHCTLBDKPQIHQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H15ClO2/c29-23-12-6-14-25-26(23)22-15-21(16-7-1-2-9-18(16)28(22)31-25)20-11-5-10-19-17-8-3-4-13-24(17)30-27(19)20/h1-15H.
What are the key properties of 7-chloro-5-dibenzofuran-4-ylnaphtho[1,2-b][1]benzofuran?
7-chloro-5-dibenzofuran-4-ylnaphtho[1,2-b][1]benzofuran has a molecular weight of 418.88 g/mol, XLogP of 8.96, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-chloro-5-dibenzofuran-4-ylnaphtho[1,2-b][1]benzofuran is sourced from PubChem (CID 167440876), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).