Chemical Properties of 2-Furanmethanol, acetate (CAS 623-17-6)

InChI

InChI=1S/C7H8O3/c1-6(8)10-5-7-3-2-4-9-7/h2-4H,5H2,1H3

InChI Key

CKOYRRWBOKMNRG-UHFFFAOYSA-N

Formula

C7H8O3

SMILES

CC(=O)OCc1ccco1

Molecular Weight¹

140.14

CAS

623-17-6

Other Names

• Furfuryl alcohol, acetate
• Acetic acid furfurylester
• Furfuryl acetate
• 2-Acetoxymethylfuran
• 2-Furanmethyl acetate
• 2-Furfuryl-acetate
• Furfuryl ethanoate

• Δ_vapH : Enthalpy of vaporization at a given temperature (kJ/mol).
• 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.
• I : 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	-5.78		Crippen Calculated Property
logPoct/wat	1.343		Crippen Calculated Property
McVol	103.340	ml/mol	McGowan Calculated Property
Inp	[955.00; 1004.00]
Inp	955.00		NIST
Inp	970.00		NIST
Inp	967.00		NIST
Inp	969.00		NIST
Inp	991.00		NIST
Inp	966.00		NIST
Inp	966.00		NIST
Inp	966.00		NIST
Inp	967.00		NIST
Inp	991.00		NIST
Inp	Outlier 1004.00		NIST
Inp	998.00		NIST
Inp	962.00		NIST
Inp	962.00		NIST
Inp	964.00		NIST
Inp	966.00		NIST
Inp	996.00		NIST
Inp	995.00		NIST
Inp	969.00		NIST
Inp	967.00		NIST
Inp	991.00		NIST
Inp	966.00		NIST
Inp	967.00		NIST
I	[1512.00; 1566.00]
I	1539.00		NIST
I	1512.00		NIST
I	1514.00		NIST
I	1524.00		NIST
I	1542.00		NIST
I	1534.00		NIST
I	1521.00		NIST
I	1521.00		NIST
I	1529.00		NIST
I	1534.00		NIST
I	1515.00		NIST
I	1554.00		NIST
I	1521.00		NIST
I	1521.00		NIST
I	1522.00		NIST
I	1523.00		NIST
I	1525.00		NIST
I	1531.00		NIST
I	1531.00		NIST
I	1557.00		NIST
I	1552.00		NIST
I	Outlier 1566.00		NIST
I	1557.00		NIST
I	1523.00		NIST
I	1542.00		NIST
I	1541.00		NIST
I	1525.00		NIST
I	1559.00		NIST
I	1559.00		NIST
I	1559.00		NIST
I	1518.00		NIST
I	1538.00		NIST
I	1539.00		NIST
I	1559.00		NIST
I	1514.00		NIST
I	1550.00		NIST
I	1518.00		NIST
I	1554.00		NIST
I	1525.00		NIST
I	1542.00		NIST
I	1534.00		NIST
I	1539.00		NIST
Tboil	[450.20; 455.35]	K
Tboil	450.20	K	NIST
Tboil	455.35 ± 0.50	K	NIST

Temperature Dependent Properties

Similar Compounds

Find more compounds similar to 2-Furanmethanol, acetate.

Sources

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

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Outlier This icon means that the value is more than 2 standard deviations away from the property mean.