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50-03-3

50-03-3 structural image
Product Name: Hydrocortisone acetate
Formula: C23H32O6
Synonyms: 11β,17α,21-Trihydroxy-4-pregnene-3,20-dione 21-acetate;17-α-Hydroxycorticosterone acetate;17-Hydroxycorticosterone 21-acetate;21-Acetoxy-4-pregnene-11β,17α-diol-3,20-dione;4-Pregnene-11β,17α,21-triol-3,20-dione 21-acetate
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CHEMICAL AND PHYSICAL PROPERTIES

Collision Cross Section 198.8 Ų [M+H]+ [CCS Type: DT, Method: single field calibrated with ESI Low Concentration Tuning Mix (Agilent)]

SAFETY INFORMATION

Signal word Danger
Pictogram(s)

Health Hazard
GHS08
GHS Hazard Statements H373:Specific target organ toxicity, repeated exposure
Precautionary Statement Codes P202:Do not handle until all safety precautions have been read and understood.
P260:Do not breathe dust/fume/gas/mist/vapours/spray.
P280:Wear protective gloves/protective clothing/eye protection/face protection.
P308+P313:IF exposed or concerned: Get medical advice/attention.
P405:Store locked up.
P501:Dispose of contents/container to..…

COMPUTED DESCRIPTORS

Molecular Weight 404.5 g/mol
XLogP3 2.2
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 6
Rotatable Bond Count 4
Exact Mass 404.21988874 g/mol
Monoisotopic Mass 404.21988874 g/mol
Topological Polar Surface Area 101 Ų
Heavy Atom Count 29
Formal Charge 0
Complexity 786
Isotope Atom Count 0
Defined Atom Stereocenter Count 7
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

Cortisol 21-acetate is a tertiary alpha-hydroxy ketone and a cortisol ester.

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