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17369-59-4

17369-59-4 structural image
Product Name: FEMA 2952
Formula: C11H10O2
Synonyms: 3-Propylidene-1(3H)-isobenzofuranone
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CHEMICAL AND PHYSICAL PROPERTIES

Physical Description 3-propylidene phthalide is a clear yellow liquid. (NTP, 1992)
Boiling Point 343 to 347 °F at 15 mmHg (NTP, 1992)
Flash Point greater than 200 °F (NTP, 1992)
Solubility less than 0.1 mg/mL at 64 °F (NTP, 1992)
Density 1.135 at 74.7 °F (NTP, 1992) - Denser than water; will sink
Refractive Index 1.557-1.562

SAFETY INFORMATION

Signal word Warning
Pictogram(s)

Exclamation Mark
Irritant
GHS07
GHS Hazard Statements H302:Acute toxicity,oral
H317:Sensitisation, Skin
Precautionary Statement Codes P280:Wear protective gloves/protective clothing/eye protection/face protection.
P302+P352:IF ON SKIN: wash with plenty of soap and water.

COMPUTED DESCRIPTORS

Molecular Weight 174.20 g/mol
XLogP3 2.6
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 2
Rotatable Bond Count 1
Exact Mass 174.068079557 g/mol
Monoisotopic Mass 174.068079557 g/mol
Topological Polar Surface Area 26.3 Ų
Heavy Atom Count 13
Formal Charge 0
Complexity 243
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 1
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes

PRODUCT INTRODUCTION

description

3-propylidene phthalide is a clear yellow liquid. (NTP, 1992)