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488-93-7

488-93-7 structural image
Product Name: 3-Furoic acid
Formula: C5H4O3
Synonyms: Furan-3-carboxylic acid
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CHEMICAL AND PHYSICAL PROPERTIES

Physical Description Solid
Melting Point 120 - 122 °C
Solubility 64 mg/mL
LogP 1.03
Kovats Retention Index 1004

SAFETY INFORMATION

Signal word Warning
Pictogram(s)

Exclamation Mark
Irritant
GHS07
GHS Hazard Statements H315:Skin corrosion/irritation
H319:Serious eye damage/eye irritation
Precautionary Statement Codes P302+P352:IF ON SKIN: wash with plenty of soap and water.
P305+P351+P338:IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continuerinsing.

COMPUTED DESCRIPTORS

Molecular Weight 112.08 g/mol
XLogP3 1
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 1
Exact Mass 112.016043985 g/mol
Monoisotopic Mass 112.016043985 g/mol
Topological Polar Surface Area 50.4 Ų
Heavy Atom Count 8
Formal Charge 0
Complexity 99.8
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes

PRODUCT INTRODUCTION

description

3-furoic acid is a furoic acid carrying the carboxy group at position 3. It has a role as a human metabolite. It is a conjugate acid of a 3-furoate.

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