CAS No.50-03-3,Hydrocortisone acetate Suppliers,MSDS download

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Basic Information

Molecular Structure:
CAS No.:	50-03-3
Name:	Hydrocortisone acetate
Article Data:	22

Formula:	C₂₃H₃₂O₆
Molecular Weight:	404.503
Synonyms:	Cortacream;Cortaid;Cortef acetate;Cortell;Corticaine;Cortifoam;Cortril acetate;Cortril acetate AS;Efcolin;HA;Hc 45;Hycortole acetate;Hydrocort acetate;Hydrocortisat;Hydrocortisone 21-acetate;Cortisolacetate (6CI);Cortisol, 21-acetate (7CI,8CI);11b,17a,21-Trihydroxypregn-4-ene-3,20-dione21-acetate;17-Hydroxycorticosterone 21-acetate;17a-Hydroxycorticosterone acetate;21-Acetoxy-11b,17-dihydroxypregn-4-en-3,20-dione;21-Acetoxy-11b,17-dihydroxypregn-4-ene-3,20-dione;21-Acetoxy-11b,17a-dihydroxypregn-4-ene-3,20-dione;Abbocort;Anusol HC;Bambicort;Berlison F;Biocortar;CaldeCort;Chemysone;Colifoam;Colofoam;Cordes;
EINECS:	200-004-4
Density:	1.26 g/cm/³
Melting Point:	223 °C (dec.)(lit.)
Boiling Point:	576.6 °C at 760 mmHg
Flash Point:	196.2 °C
Solubility:	Insoluble in water.
Appearance:	white powder
Hazard Symbols:	Xn
Risk Codes:	63
Safety:	36/37
PSA:	100.90000
LogP:	2.35240

Synthetic route

: 50-23-7
HYDROCORTISONE

: 108-24-7
acetic anhydride

: 50-03-3
hydrocortisone acetate

Conditions

Conditions	Yield
With pyridine at 20℃;	100%
With pyridine at 0 - 25℃; for 24h;	99%
With pyridine at 0 - 20℃;	91%

: 50-23-7
HYDROCORTISONE

: 79-20-9
acetic acid methyl ester

: 50-03-3
hydrocortisone acetate

Conditions

Conditions	Yield
With Candida antarctica lipase B In ethyl acetate at 55℃; regioselective reaction;	92%

: 21940-45-4
Δ6-hydrocortisone-21-acetate

A: 50-03-3
hydrocortisone acetate

B: 11β,17α-dihydroxy-21-acetoxy-5α/5β-pregnan-3-one

Conditions

Conditions	Yield
With hydrogen; Pd/SrCO3 In ethyl acetate for 0.333333h; atmospheric pressure;	A 42% B 19%

: 463-51-4
Ketene

: 50-23-7
HYDROCORTISONE

: 50-03-3
hydrocortisone acetate

Conditions

Conditions	Yield
With acetone

: 31085-34-4
21-acetoxy-11β-hydroxy-pregna-4,17(20)c-dien-3-one

: 50-03-3
hydrocortisone acetate

Conditions

Conditions	Yield
With osmium(VIII) oxide; [bis(acetoxy)iodo]benzene
With osmium(VIII) oxide; triethylamine N-oxide; dihydrogen peroxide

: 114160-28-0
4β-chloro-17-hydroxy-5β-pregnane-3,11,20-trione

: 50-03-3
hydrocortisone acetate

Conditions

Conditions	Yield
ueber mehrere Stufen;

: 119180-68-6
21-acetoxy-11β-hydroxy-pregna-4,17(20)t-dien-3-one

: 50-03-3
hydrocortisone acetate

Conditions

Conditions	Yield
With osmium(VIII) oxide; [bis(acetoxy)iodo]benzene
With osmium(VIII) oxide; triethylamine N-oxide; dihydrogen peroxide

: 64313-94-6
RU 18760

: 50-03-3
hydrocortisone acetate

Conditions

Conditions	Yield
With bromine dann mit Semicarbazid und anschliessend mit Brenztraubensaeure;

: 108-05-4
vinyl acetate

: 50-23-7
HYDROCORTISONE

: 50-03-3
hydrocortisone acetate

Conditions

Conditions	Yield
With Candida antarctica lipase B In tetrahydrofuran at 45℃; for 4h; Yield given;

: 102213-14-9
22-acetoxy-11β-hydroxy-3-oxo-23,24-dinor-5β-chol-17(20)ξ-ene-21-nitrile

: 50-03-3
hydrocortisone acetate

Conditions

Conditions	Yield
Multi-step reaction with 2 steps 1: OsO4 2: bromine / dann mit Semicarbazid und anschliessend mit Brenztraubensaeure View Scheme

Raw Materials

10025-73-7

50-23-7

108-24-7

108-05-4

641-78-1

29042-01-1

64313-94-6

463-51-4

Downstream Products

516-41-6

382-44-5

50-04-4

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Specification

1. Introduction of Hydrocortisone acetate
Hydrocortisone acetate is one kind of white powder. The IUPAC Name of this chemical is [2-[(8S,9S,10R,11S,13S,14S,17R)-11,17-dihydroxy-10,13-dimethyl-3-oxo-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-17-yl]-2-oxoethyl] acetate. Besides, Hydrocortisone acetate stability is stable, but may be light or moisture sensitive. It is incompatible with strong oxidizing agents. Hydrocortisone acetate belongs to Biochemistry;Hydroxyketosteroids;Steroids;Intermediates & Fine Chemicals;Pharmaceuticals;Veterinaries;Steroid and Hormone.

The Classification Code of this chemical is Anti-Inflammatory Agents; Drug / Therapeutic Agent; Glucocorticoid; Mutation data; Reproductive Effect.

2. Properties of Hydrocortisone acetate
Physical properties about Hydrocortisone acetate are:
(1)Nominal Mass: 404 Da; (2)Average Mass: 404.4966 Da; (3)Monoisotopic Mass: 404.219889 Da; (4)Index of Refraction: 1.572; (5)Molar Refractivity: 105.15 cm³; (6)Molar Volume: 319.2 cm³; (7)Surface Tension: 54.6 dyne/cm; (8)Density: 1.26 g/cm³; (9)Flash Point: 196.2 °C; (10)Enthalpy of Vaporization: 99.14 kJ/mol; (11)Boiling Point: 576.6 °C at 760 mmHg; (12)Vapour Pressure: 1.08E-15 mmHg at 25°C; (13)Storage temp: 0-6°C; (14)Decomposition: 223°C.

3. Structure Descriptors of Hydrocortisone acetate
(1)InChI: InChI=1S/C23H32O6/c1-13(24)29-12-19(27)23(28)9-7-17-16-5-4-14-10-15(25)6-8-21(14,2)20(16)18(26)11-22(17,23)3/h10,16-18,20,26,28H,4-9,11-12H2,1-3H3/t16-,17-,18-,20+,21-,22-,23-/m0/s1
(2)InChIKey: InChIKey=ALEXXDVDDISNDU-JZYPGELDSA-N
(3)Smiles: C1[C@@]2([C@H]([C@H]3[C@H]([C@@]4(C(=CC(=O)CC4)CC3)C)[C@H]1O)CC[C@@]2(C(COC(C)=O)=O)O)C

4. Toxicity of Hydrocortisone acetate

Organism	Test Type	Route	Reported Dose (Normalized Dose)	Source
mouse	LD50	intraperitoneal	2300mg/kg (2300mg/kg)	Compilation of LD50 Values of New Drugs.
mouse	LD50	subcutaneous	45050ug/kg (45.05mg/kg)	National Cancer Institute Screening Program Data Summary, Developmental Therapeutics Program. Vol. JAN1986,
rat	LDLo	subcutaneous	250mg/kg (250mg/kg)	Arzneimittel-Forschung. Drug Research. Vol. 27, Pg. 2102, 1977.

RTECS : GM8960000

5. Safety information of Hydrocortisone acetate
Hazard Codes: Harmful Xn
Risk Statements: 63
R63: Possible risk of harm to the unborn child
Safety Statements: 36/37
S36/37: Wear suitable protective clothing and gloves
WGK Germany: 3

6. Uses of Hydrocortisone acetate
Hydrocortisone acetate can be used for biochemical research. As a sugar cortical hormone drug, it can anti-inflammatory, anti-allergic, antitoxin, resistance to shock action.

7. Production of Hydrocortisone acetate
Hydrocortisone and Acetic anhydride esterification under the condition of Azabenzene can be used to manufacture Hydrocortisone acetate.