Chemical Properties of Furan, 2-(1,1-dimethylethyl)-4-methyl- (CAS 6141-68-0)

InChI

InChI=1S/C9H14O/c1-7-5-8(10-6-7)9(2,3)4/h5-6H,1-4H3

InChI Key

DDXRLYGFNYHBOK-UHFFFAOYSA-N

Formula

C9H14O

SMILES

Cc1coc(C(C)(C)C)c1

Molecular Weight¹

138.21

CAS

6141-68-0

Other Names

• Furan, 2-tert-butyl-4-methyl-
• 2-tert-Butyl-4-methylfuran

• 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_boil : Normal Boiling Point Temperature (K).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
log10WS	-6.99		Crippen Calculated Property
logPoct/wat	2.886		Crippen Calculated Property
McVol	124.080	ml/mol	McGowan Calculated Property
Inp	[915.00; 915.00]
Inp	915.00		NIST
Inp	915.00		NIST
Tboil	419.65 ± 1.00	K	NIST

Similar Compounds

Find more compounds similar to Furan, 2-(1,1-dimethylethyl)-4-methyl-.

Sources

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

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