6-chloro-10-phenylnaphtho[1,2-b][1]benzofuran

C22H13ClO — CID 176775460

IUPAC6-chloro-10-phenylnaphtho[1,2-b][1]benzofuran
SMILESClc1cc2ccccc2c2oc3c(-c4ccccc4)cccc3c12
InChIInChI=1S/C22H13ClO/c23-19-13-15-9-4-5-10-17(15)22-20(19)18-12-6-11-16(21(18)24-22)14-7-2-1-3-8-14/h1-13H
InChIKeySQPGJRPSOJMHOR-UHFFFAOYSA-N
MW328.80 g/mol
LogP7.06
Rot. Bonds1

About 6-chloro-10-phenylnaphtho[1,2-b][1]benzofuran

6-chloro-10-phenylnaphtho[1,2-b][1]benzofuran (PubChem CID 176775460) has the molecular formula C22H13ClO and a molecular weight of 328.80 g/mol. Its IUPAC name is 6-chloro-10-phenylnaphtho[1,2-b][1]benzofuran.

Molecular Properties

Compound Name6-chloro-10-phenylnaphtho[1,2-b][1]benzofuran
PubChem CID176775460
Molecular FormulaC22H13ClO
Molecular Weight328.80 g/mol
Exact Mass328.07
IUPAC Name6-chloro-10-phenylnaphtho[1,2-b][1]benzofuran
SMILESClc1cc2ccccc2c2oc3c(-c4ccccc4)cccc3c12
InChIInChI=1S/C22H13ClO/c23-19-13-15-9-4-5-10-17(15)22-20(19)18-12-6-11-16(21(18)24-22)14-7-2-1-3-8-14/h1-13H
InChIKeySQPGJRPSOJMHOR-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

N-(4-phenanthren-9-ylphenyl)-10-phenyl-N-(4-phenylphenyl)naphtho[1,2-b][1]benzofuran-6-amine
CID 167277671
8-methyl-6-(2-phenylphenyl)naphtho[2,1-b][1]benzofuran
CID 130290646
1,6-diphenyldibenzofuran
CID 145331756
4-phenyl-6-[7-(6-phenylnaphthalen-2-yl)pyren-2-yl]dibenzofuran
CID 174253549
2-(1,6-diphenyldibenzofuran-4-yl)-4,6-diphenyl-1,3,5-triazine
CID 164838475
2,6-diphenyl-4-[4-(6-phenyldibenzofuran-4-yl)phenyl]pyridine
CID 171761157
7,9,13-triphenyl-11-oxapentacyclo[10.7.1.12,6.016,20.010,21]henicosa-1(19),2(21),3,5,7,9,12,14,16(20),17-decaene
CID 118145411
N-[4-(4-naphthalen-1-ylnaphthalen-2-yl)phenyl]-N-phenyl-4-(6-phenyldibenzofuran-4-yl)aniline
CID 175611063
1-chloro-4-dibenzofuran-4-yl-6,8-diphenyldibenzofuran
CID 139479644
N-[4-(3-oxapentacyclo[11.8.0.02,10.04,9.016,21]henicosa-1(13),2(10),4(9),5,7,11,14,16,18,20-decaen-5-yl)phenyl]-4-phenyl-N-(4-phenylphenyl)aniline
CID 130466777
2-[4-(3-oxapentacyclo[11.8.0.02,10.04,9.016,21]henicosa-1(13),2(10),4(9),5,7,11,14,16,18,20-decaen-5-yl)phenyl]-4,6-bis(4-phenylphenyl)-1,3,5-triazine
CID 139447245
N-(4-naphtho[2,1-b][1]benzofuran-6-ylphenyl)-N-[4-(6-phenylnaphtho[2,1-b][1]benzofuran-8-yl)phenyl]-4-(4-phenylphenyl)aniline
CID 134337496

Frequently Asked Questions

What is the IUPAC name of 6-chloro-10-phenylnaphtho[1,2-b][1]benzofuran?
The IUPAC name of 6-chloro-10-phenylnaphtho[1,2-b][1]benzofuran (CID 176775460) is 6-chloro-10-phenylnaphtho[1,2-b][1]benzofuran.
What is the SMILES notation for 6-chloro-10-phenylnaphtho[1,2-b][1]benzofuran?
The canonical SMILES for 6-chloro-10-phenylnaphtho[1,2-b][1]benzofuran is Clc1cc2ccccc2c2oc3c(-c4ccccc4)cccc3c12.
What is the InChIKey of 6-chloro-10-phenylnaphtho[1,2-b][1]benzofuran?
The InChIKey is SQPGJRPSOJMHOR-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H13ClO/c23-19-13-15-9-4-5-10-17(15)22-20(19)18-12-6-11-16(21(18)24-22)14-7-2-1-3-8-14/h1-13H.
What are the key properties of 6-chloro-10-phenylnaphtho[1,2-b][1]benzofuran?
6-chloro-10-phenylnaphtho[1,2-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 6-chloro-10-phenylnaphtho[1,2-b][1]benzofuran is sourced from PubChem (CID 176775460), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).