2-(2-chlorophenyl)benzo[e][1]benzofuran

C18H11ClO — CID 838342

IUPAC2-(2-chlorophenyl)benzo[e][1]benzofuran
SMILESClc1ccccc1-c1cc2c(ccc3ccccc32)o1
InChIInChI=1S/C18H11ClO/c19-16-8-4-3-7-14(16)18-11-15-13-6-2-1-5-12(13)9-10-17(15)20-18/h1-11H
InChIKeyBJJMZLJZPZRFNJ-UHFFFAOYSA-N
MW278.74 g/mol
LogP5.91
Rot. Bonds1

About 2-(2-chlorophenyl)benzo[e][1]benzofuran

2-(2-chlorophenyl)benzo[e][1]benzofuran (PubChem CID 838342) has the molecular formula C18H11ClO and a molecular weight of 278.74 g/mol. Its IUPAC name is 2-(2-chlorophenyl)benzo[e][1]benzofuran.

Molecular Properties

Compound Name2-(2-chlorophenyl)benzo[e][1]benzofuran
PubChem CID838342
Molecular FormulaC18H11ClO
Molecular Weight278.74 g/mol
Exact Mass278.05
IUPAC Name2-(2-chlorophenyl)benzo[e][1]benzofuran
SMILESClc1ccccc1-c1cc2c(ccc3ccccc32)o1
InChIInChI=1S/C18H11ClO/c19-16-8-4-3-7-14(16)18-11-15-13-6-2-1-5-12(13)9-10-17(15)20-18/h1-11H
InChIKeyBJJMZLJZPZRFNJ-UHFFFAOYSA-N
XLogP5.91
TPSA13.14 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500278.74
LogP ≤ 55.91
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

2-(2-chlorophenyl)benzo[h]chromen-4-one
CID 11266772
6-chloro-2-(2-chlorophenyl)chromen-4-one
CID 688872
[2-(2-chlorophenyl)-6-methoxychromen-4-ylidene]-naphthalen-1-ylazanium perchlorate
CID 20999011
2-(2-chlorophenyl)-6-hydroxychromen-4-one
CID 14982999
2-benzo[e][1]benzofuran-2-yl-5-phenyl-1,3,4-oxadiazole
CID 71377583
3-(2,6-dichlorophenyl)benzo[f]chromen-1-one
CID 56833936
2,8-di(chrysen-6-yl)dibenzofuran
CID 87692920
2-fluoranthen-2-yl-8-phenanthren-3-yldibenzofuran
CID 129100719
benzyl-[2-(2-chlorophenyl)-6-methoxychromen-4-ylidene]azanium perchlorate
CID 20999004
2-(2-chlorophenyl)-7-deuteriodibenzofuran
CID 171449495
9-chloro-12-oxapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene
CID 166918306
9-(2-chlorophenyl)pentacyclo[12.8.0.02,11.03,8.017,22]docosa-1(14),2(11),3,5,7,9,12,15,17,19,21-undecaene
CID 177100175

Frequently Asked Questions

What is the IUPAC name of 2-(2-chlorophenyl)benzo[e][1]benzofuran?
The IUPAC name of 2-(2-chlorophenyl)benzo[e][1]benzofuran (CID 838342) is 2-(2-chlorophenyl)benzo[e][1]benzofuran.
What is the SMILES notation for 2-(2-chlorophenyl)benzo[e][1]benzofuran?
The canonical SMILES for 2-(2-chlorophenyl)benzo[e][1]benzofuran is Clc1ccccc1-c1cc2c(ccc3ccccc32)o1.
What is the InChIKey of 2-(2-chlorophenyl)benzo[e][1]benzofuran?
The InChIKey is BJJMZLJZPZRFNJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H11ClO/c19-16-8-4-3-7-14(16)18-11-15-13-6-2-1-5-12(13)9-10-17(15)20-18/h1-11H.
What are the key properties of 2-(2-chlorophenyl)benzo[e][1]benzofuran?
2-(2-chlorophenyl)benzo[e][1]benzofuran has a molecular weight of 278.74 g/mol, XLogP of 5.91, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-chlorophenyl)benzo[e][1]benzofuran is sourced from PubChem (CID 838342), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).