6-(7-chloronaphthalen-2-yl)naphtho[2,1-b][1]benzofuran

C26H15ClO — CID 177271135

IUPAC6-(7-chloronaphthalen-2-yl)naphtho[2,1-b][1]benzofuran
SMILESClc1ccc2ccc(-c3cc4ccccc4c4c3oc3ccccc34)cc2c1
InChIInChI=1S/C26H15ClO/c27-20-12-11-16-9-10-18(13-19(16)14-20)23-15-17-5-1-2-6-21(17)25-22-7-3-4-8-24(22)28-26(23)25/h1-15H
InChIKeySHPSMQPYJNTBPL-UHFFFAOYSA-N
MW378.86 g/mol
LogP8.21
Rot. Bonds1

About 6-(7-chloronaphthalen-2-yl)naphtho[2,1-b][1]benzofuran

6-(7-chloronaphthalen-2-yl)naphtho[2,1-b][1]benzofuran (PubChem CID 177271135) has the molecular formula C26H15ClO and a molecular weight of 378.86 g/mol. Its IUPAC name is 6-(7-chloronaphthalen-2-yl)naphtho[2,1-b][1]benzofuran.

Molecular Properties

Compound Name6-(7-chloronaphthalen-2-yl)naphtho[2,1-b][1]benzofuran
PubChem CID177271135
Molecular FormulaC26H15ClO
Molecular Weight378.86 g/mol
Exact Mass378.08
IUPAC Name6-(7-chloronaphthalen-2-yl)naphtho[2,1-b][1]benzofuran
SMILESClc1ccc2ccc(-c3cc4ccccc4c4c3oc3ccccc34)cc2c1
InChIInChI=1S/C26H15ClO/c27-20-12-11-16-9-10-18(13-19(16)14-20)23-15-17-5-1-2-6-21(17)25-22-7-3-4-8-24(22)28-26(23)25/h1-15H
InChIKeySHPSMQPYJNTBPL-UHFFFAOYSA-N
XLogP8.21
TPSA13.14 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500378.86
LogP ≤ 58.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

6-[3-(10-phenylanthracen-9-yl)phenyl]naphtho[2,1-b][1]benzofuran
CID 86667299
N-(4-naphthalen-2-ylphenyl)-N-(4-naphtho[2,1-b][1]benzofuran-6-ylphenyl)-3-phenylaniline
CID 170030961
6-[3-(9,10-diphenylanthracen-2-yl)phenyl]naphtho[2,1-b][1]benzofuran
CID 88539783
6-[3-[9,10-bis(4-methylphenyl)anthracen-2-yl]phenyl]naphtho[2,1-b][1]benzofuran;6-[3-[9,10-bis(3-phenylphenyl)anthracen-2-yl]phenyl]naphtho[2,1-b][1]benzofuran;6-[3-(9,10-dinaphthalen-2-ylanthracen-2-yl)phenyl]naphtho[2,1-b][1]benzofuran
CID 159916056
6-[4-[2,3-di(ethylidene)-4-phenylnaphthalen-1-yl]phenyl]naphtho[2,1-b][1]benzofuran
CID 123620919
2-(9-chloronaphtho[1,2-b][1]benzofuran-6-yl)-4-naphthalen-2-yl-6-phenyl-1,3,5-triazine
CID 155122129
14,31-bis(naphtho[2,1-b][1]benzofuran-9-yl)-12,17,29,34-tetraoxanonacyclo[18.14.0.03,18.04,16.05,13.06,11.021,33.022,30.023,28]tetratriaconta-1(20),2,4(16),5(13),6,8,10,14,18,21(33),22(30),23,25,27,31-pentadecaene
CID 134556960
6-[8-naphtho[2,1-b][1]benzofuran-6-yl-10-(4-phenylnaphthalen-2-yl)anthracen-1-yl]naphtho[2,1-b][1]benzofuran
CID 155335028
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
N-(4-naphtho[2,1-b][1]benzofuran-6-ylphenyl)-4-phenyl-N-[4-(6-phenylnaphtho[2,1-b][1]benzofuran-8-yl)phenyl]aniline
CID 134337497
10-[3,5-bis(12-oxapentacyclo[11.8.0.02,11.03,8.015,20]henicosa-1(21),2(11),3,5,7,9,13,15,17,19-decaen-10-yl)phenyl]-12-oxapentacyclo[11.8.0.02,11.03,8.015,20]henicosa-1(21),2(11),3,5,7,9,13,15,17,19-decaene
CID 121325371
1-(4-bromophenyl)-4-(4-chlorophenyl)dibenzofuran
CID 162517717

Frequently Asked Questions

What is the IUPAC name of 6-(7-chloronaphthalen-2-yl)naphtho[2,1-b][1]benzofuran?
The IUPAC name of 6-(7-chloronaphthalen-2-yl)naphtho[2,1-b][1]benzofuran (CID 177271135) is 6-(7-chloronaphthalen-2-yl)naphtho[2,1-b][1]benzofuran.
What is the SMILES notation for 6-(7-chloronaphthalen-2-yl)naphtho[2,1-b][1]benzofuran?
The canonical SMILES for 6-(7-chloronaphthalen-2-yl)naphtho[2,1-b][1]benzofuran is Clc1ccc2ccc(-c3cc4ccccc4c4c3oc3ccccc34)cc2c1.
What is the InChIKey of 6-(7-chloronaphthalen-2-yl)naphtho[2,1-b][1]benzofuran?
The InChIKey is SHPSMQPYJNTBPL-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H15ClO/c27-20-12-11-16-9-10-18(13-19(16)14-20)23-15-17-5-1-2-6-21(17)25-22-7-3-4-8-24(22)28-26(23)25/h1-15H.
What are the key properties of 6-(7-chloronaphthalen-2-yl)naphtho[2,1-b][1]benzofuran?
6-(7-chloronaphthalen-2-yl)naphtho[2,1-b][1]benzofuran has a molecular weight of 378.86 g/mol, XLogP of 8.21, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(7-chloronaphthalen-2-yl)naphtho[2,1-b][1]benzofuran is sourced from PubChem (CID 177271135), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).