8-chloro-3-phenylnaphtho[2,1-b][1]benzofuran

C22H13ClO — CID 155335388

IUPAC8-chloro-3-phenylnaphtho[2,1-b][1]benzofuran
SMILESClc1cccc2c1oc1ccc3cc(-c4ccccc4)ccc3c12
InChIInChI=1S/C22H13ClO/c23-19-8-4-7-18-21-17-11-9-15(14-5-2-1-3-6-14)13-16(17)10-12-20(21)24-22(18)19/h1-13H
InChIKeyJOUDLPVIOQHQOK-UHFFFAOYSA-N
MW328.80 g/mol
LogP7.06
Rot. Bonds1

About 8-chloro-3-phenylnaphtho[2,1-b][1]benzofuran

8-chloro-3-phenylnaphtho[2,1-b][1]benzofuran (PubChem CID 155335388) has the molecular formula C22H13ClO and a molecular weight of 328.80 g/mol. Its IUPAC name is 8-chloro-3-phenylnaphtho[2,1-b][1]benzofuran.

Molecular Properties

Compound Name8-chloro-3-phenylnaphtho[2,1-b][1]benzofuran
PubChem CID155335388
Molecular FormulaC22H13ClO
Molecular Weight328.80 g/mol
Exact Mass328.07
IUPAC Name8-chloro-3-phenylnaphtho[2,1-b][1]benzofuran
SMILESClc1cccc2c1oc1ccc3cc(-c4ccccc4)ccc3c12
InChIInChI=1S/C22H13ClO/c23-19-8-4-7-18-21-17-11-9-15(14-5-2-1-3-6-14)13-16(17)10-12-20(21)24-22(18)19/h1-13H
InChIKeyJOUDLPVIOQHQOK-UHFFFAOYSA-N
XLogP7.06
TPSA13.14 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500328.80
LogP ≤ 57.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

2-(8-chloronaphtho[2,1-b][1]benzofuran-2-yl)-4-phenanthren-2-yl-6-phenyl-1,3,5-triazine
CID 155378825
N-(4-naphthalen-2-ylphenyl)-N,3-bis(4-phenylphenyl)naphtho[2,1-b][1]benzofuran-8-amine
CID 177131034
N-(4-benzo[g]phenanthren-3-ylphenyl)-N-(4-phenylphenyl)naphtho[2,1-b][1]benzofuran-8-amine
CID 167183316
6,18-diphenyl-12-oxapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3(8),4,6,9,14,16(21),17,19-decaene
CID 102362989
7-chloro-2-(4-phenylphenyl)-[1]benzofuro[2,3-g][1,3]benzoxazole
CID 167123613
N-dibenzofuran-2-yl-N,3-diphenylnaphtho[2,1-b][1]benzofuran-8-amine
CID 177131058
N-[4-(4-naphtho[2,1-b][1]benzofuran-3-ylphenyl)phenyl]-N,4-diphenylaniline
CID 170127431
6-chloro-1,3-diphenyldibenzofuran
CID 164884878
18-[10-(6-phenylnaphthalen-2-yl)anthracen-9-yl]-12,15-dioxahexacyclo[11.11.0.02,11.03,8.014,22.016,21]tetracosa-1(13),2(11),3,5,7,9,14(22),16(21),17,19,23-undecaene
CID 130190099
N-(3-oxapentacyclo[11.8.0.02,10.04,9.016,21]henicosa-1(13),2(10),4,6,8,11,14,16(21),17,19-decaen-18-yl)-N-phenyl-3-oxapentacyclo[11.8.0.02,10.04,9.016,21]henicosa-1(13),2(10),4,6,8,11,14,16(21),17,19-decaen-18-amine;N-(3-oxapentacyclo[11.8.0.02,10.04,9.016,21]henicosa-1(13),2(10),4,6,8,11,14,16(21),17,19-decaen-18-yl)-N-(4-phenylphenyl)-3-oxapentacyclo[11.8.0.02,10.04,9.016,21]henicosa-1(13),2(10),4,6,8,11,14,16(21),17,19-decaen-18-amine;N-[4-(3-oxapentacyclo[11.8.0.02,10.04,9.016,21]henicosa-1(13),2(10),4,6,8,11,14,16(21),17,19-decaen-18-yl)phenyl]-3-phenyl-N-(4-phenylphenyl)aniline
CID 159701047
16-[3-[10-(4-naphthalen-2-ylphenyl)anthracen-9-yl]phenyl]-12-oxapentacyclo[11.8.0.02,11.03,8.014,19]henicosa-1(13),2(11),3,5,7,9,14(19),15,17,20-decaene
CID 130188793
17-[4-(10-naphthalen-1-ylanthracen-9-yl)phenyl]-12-oxapentacyclo[11.8.0.02,11.03,8.014,19]henicosa-1(13),2(11),3,5,7,9,14(19),15,17,20-decaene
CID 130188634

Frequently Asked Questions

What is the IUPAC name of 8-chloro-3-phenylnaphtho[2,1-b][1]benzofuran?
The IUPAC name of 8-chloro-3-phenylnaphtho[2,1-b][1]benzofuran (CID 155335388) is 8-chloro-3-phenylnaphtho[2,1-b][1]benzofuran.
What is the SMILES notation for 8-chloro-3-phenylnaphtho[2,1-b][1]benzofuran?
The canonical SMILES for 8-chloro-3-phenylnaphtho[2,1-b][1]benzofuran is Clc1cccc2c1oc1ccc3cc(-c4ccccc4)ccc3c12.
What is the InChIKey of 8-chloro-3-phenylnaphtho[2,1-b][1]benzofuran?
The InChIKey is JOUDLPVIOQHQOK-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H13ClO/c23-19-8-4-7-18-21-17-11-9-15(14-5-2-1-3-6-14)13-16(17)10-12-20(21)24-22(18)19/h1-13H.
What are the key properties of 8-chloro-3-phenylnaphtho[2,1-b][1]benzofuran?
8-chloro-3-phenylnaphtho[2,1-b][1]benzofuran has a molecular weight of 328.80 g/mol, XLogP of 7.06, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 8-chloro-3-phenylnaphtho[2,1-b][1]benzofuran is sourced from PubChem (CID 155335388), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).