Chemical Properties of Benzo[b]naphtho[2,3-d]furan (CAS 243-42-5)

InChI

InChI=1S/C16H10O/c1-2-6-12-10-16-14(9-11(12)5-1)13-7-3-4-8-15(13)17-16/h1-10H

InChI Key

FTMRMQALUDDFQO-UHFFFAOYSA-N

Formula

C16H10O

SMILES

c1ccc2cc3c(cc2c1)oc1ccccc13

Molecular Weight¹

218.25

CAS

243-42-5

Other Names

• Benzonaphthofuran

• log₁₀WS : Log10 of Water solubility in mol/l.
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• I_np : Non-polar retention indices.
• T_fus : Normal melting (fusion) point (K).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
log10WS	-10.62		Crippen Calculated Property
logPoct/wat	4.739		Crippen Calculated Property
McVol	164.330	ml/mol	McGowan Calculated Property
Inp	[349.06; 2104.00]
Inp	Outlier 2089.00		NIST
Inp	Outlier 2104.00		NIST
Inp	356.83		NIST
Inp	353.60		NIST
Inp	358.58		NIST
Inp	354.30		NIST
Inp	353.47		NIST
Inp	353.47		NIST
Inp	349.06		NIST
Inp	354.09		NIST
Inp	349.26		NIST
Inp	354.37		NIST
Inp	356.83		NIST
Tfus	479.30 ± 1.00	K	NIST

Similar Compounds

Find more compounds similar to Benzo[b]naphtho[2,3-d]furan.

Sources

• Crippen Method
• Crippen Method
• McGowan Method
• NIST Webbook

Note: Cheméo is only indexing the data, follow the source links to retrieve the latest data. The source is also providing more information like the publication year, authors and more. Take the time to validate and double check the source of the data.
Outlier This icon means that the value is more than 2 standard deviations away from the property mean.