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125-29-1

125-29-1 structural image
Product Name: HYDROCODONE
Formula: C18H21NO3
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CHEMICAL AND PHYSICAL PROPERTIES

Physical Description Solid
Color/Form Prisms from alcohol
Melting Point 198 °C
Flash Point 9.7 °C (49.5 °F) - closed cup
Solubility Soluble in acetone, ethyl acetate, chloroform
LogP 1.2
Stability/Shelf Life Stable under recommended storage conditions.
Optical Rotation Specific optical rotation = -203 deg at 25 °C/D ( c = 0.41 in CHCL3)
Decomposition When heated to decomposition it emits toxic fumes of /nitrogen oxide/.
Dissociation Constants pKa = 8.23
Collision Cross Section 167.4 Ų [M+H]+ [CCS Type: TW, Method: Major Mix IMS/Tof Calibration Kit (Waters)]
Other Experimental Properties Crystals; melting point 185-186 °C, decomposes; specific optical rotation: -130 deg at 27 °C/D (ce = 2.877 g ub 100 mL water); very sol in water /Hydrocodone hydrochloride/

SAFETY INFORMATION

Signal word Danger
Pictogram(s)

Flame
Flammables
GHS02

Skull and Crossbones
Acute Toxicity
GHS06

Health Hazard
GHS08
GHS Hazard Statements H225:Flammable liquids
H370:Specific target organ toxicity, single exposure
Precautionary Statement Codes P210:Keep away from heat/sparks/open flames/hot surfaces. — No smoking.
P260:Do not breathe dust/fume/gas/mist/vapours/spray.
P280:Wear protective gloves/protective clothing/eye protection/face protection.
P311:Call a POISON CENTER or doctor/physician.
P301+P310:IF SWALLOWED: Immediately call a POISON CENTER or doctor/physician.

COMPUTED DESCRIPTORS

Molecular Weight 299.4 g/mol
XLogP3 2.2
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 1
Exact Mass 299.15214353 g/mol
Monoisotopic Mass 299.15214353 g/mol
Topological Polar Surface Area 38.8 Ų
Heavy Atom Count 22
Formal Charge 0
Complexity 509
Isotope Atom Count 0
Defined Atom Stereocenter Count 4
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

Hydrocodone is a morphinane-like compound that is a semi-synthetic opioid synthesized from codeine. It has a role as a mu-opioid receptor agonist, an opioid analgesic and an antitussive. It is an organic heteropentacyclic compound and a morphinane-like compound. It derives from a hydride of a morphinan.