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52-66-4

Basic Information
CAS No.: 52-66-4
Name: DL-PENICILLAMINE
Article Data: 21
Molecular Structure:
Molecular Structure of 52-66-4 (DL-PENICILLAMINE)
Formula: C5H11 N O2 S
Molecular Weight: 149.214
Synonyms: DL-Valine,3-mercapto-; Valine, 3-mercapto-, DL- (8CI); (?à)-Penicillamine; 2-Amino-3-mercapto-3-methylbutyricacid; Cysteine, 3,3-dimethyl-; DL-3-Mercaptovaline; DL-Penicillamine; DL-b-Mercaptovaline; DMC; NSC 22880;NSC 44656; b,b-Dimethylcysteine; b-Mercaptovaline; b-Thiovaline
Density: 1.204g/cm3
Melting Point: 204-208 °C(lit.)
Boiling Point: 251.8°Cat760mmHg
Flash Point: 106.1°C
Solubility: Soluble in ethanol, hot water and sodium hydroxide.
Hazard Symbols: Xn
Risk Codes: R22;
Safety: Poison by ingestion and intraperitoneal routes. Mutation data reported. When heated to decomposition it emits toxic fumes of SOx and NOx.
PSA: 102.12000
LogP: 0.80700
Synthetic route
52-66-4

DL-Penicillamin

Conditions
ConditionsYield
With hydrogenchloride
507-09-5

thioacetic acid

6642-21-3

2-acetylamino-3-methyl-crotonic acid

52-66-4

DL-Penicillamin

Conditions
ConditionsYield
Behandeln des Reaktionsprodukts mit Essigsaeure und wss.HCl;
71-47-6

formate

15784-30-2

2-amino-2-carboxy-1,1-dimethyl-ethylsulfanyl

A

52-66-4

DL-Penicillamin

B

14485-07-5

formate radical

Conditions
ConditionsYield
In various solvent(s) at 23℃; Equilibrium constant; pH 6;
15784-30-2

2-amino-2-carboxy-1,1-dimethyl-ethylsulfanyl

A

52-66-4

DL-Penicillamin

C4H10O2S2(2-)

Conditions
ConditionsYield
In water at 23℃; Thermodynamic data; pH=6.0; phosphate buffer; ΔGo;
113-98-4

Penicillin G potassium

52-66-4

DL-Penicillamin

Conditions
ConditionsYield
In acetonitrile at 37℃; for 72h; Mechanism; Rate constant; pH=2.5;

C51H76N16O14S3

C51H76N16O14S3

A

52-66-4

DL-Penicillamin

Conditions
ConditionsYield
In water at 25℃; for 5h; Rate constant; Equilibrium constant; pH 7.0;

C48H77N13O14S3

C48H77N13O14S3

A

52-66-4

DL-Penicillamin

B

50-56-6

oxytocin

Conditions
ConditionsYield
In water at 25℃; for 5h; Rate constant; Equilibrium constant; pH 7.0;
(+-)-2.5.5-trimethyl-Δ2-thiazoline-carboxylic acid-(4)-ethyl ester

(+-)-2.5.5-trimethyl-Δ2-thiazoline-carboxylic acid-(4)-ethyl ester

52-66-4

DL-Penicillamin

Conditions
ConditionsYield
With hydrogen bromide
With hydrogenchloride
2-thioxo-5.5-dimethyl-thiazolidine-carboxylic acid-(4)

2-thioxo-5.5-dimethyl-thiazolidine-carboxylic acid-(4)

52-66-4

DL-Penicillamin

Conditions
ConditionsYield
With hydrogenchloride; aluminium
S-benzyl-penicillamine

S-benzyl-penicillamine

52-66-4

DL-Penicillamin

Conditions
ConditionsYield
With ammonia; sodium
With hydrogen bromide
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Chemistry

IUPAC Name: 2-Amino-3-methyl-3-sulfanylbutanoic acid
The MF of Dl-penicillamine (CAS NO.52-66-4) is C5H11NO2S.

                           
The MW of Dl-penicillamine (CAS NO.52-66-4) is 149.21.
Synonyms of Dl-penicillamine (CAS NO.52-66-4): (2S)-2-Amino-3-methyl-3-sulfanylbutansaure ; 3-Sulfanyl-D-valine ; b,b-Dimethylcysteine ; b-Thiovaline ; Distamine
Product Categories: Amino Acids;Antibiotics;Analytical Chemistry;Biochemistry;Ligands for Pharmaceutical Research;non-Proteinorganic Amino Acids;Radiopharmaceutical Chemistry
Index of Refraction: 1.527  
Appearance: white powder
EINECS: 200-147-2
Density: 1.204 g/ml 
Flash Point: 106.1 °C
Boiling Point: 251.8 °C
Melting Point: 4-8 °C
storage temp: 2-8 °C
Merck: 14,7088
BRN: 2039817

Uses

  Dl-penicillamine (CAS NO.52-66-4) is used in chemical reagents, organic intermediates, fine chemicals, pharmaceutical research and development.

Toxicity Data With Reference

1.    

pic-esc 100 mg/L

    APMBAY    Applied Microbiology. 12 (1964),234.
2.    

orl-rat LD50:365 mg/kg

    ARZNAD    Arzneimittel-Forschung. Drug Research. 22 (1972),1434.
3.    

ipr-mus LD50:358 mg/kg

    TOLED5    Toxicology Letters. 26 (1985),95.

Safety Profile

Poison by ingestion and intraperitoneal routes. Mutation data reported. When heated to decomposition it emits toxic fumes of SOx and NOx.Safety information of Dl-penicillamine (CAS NO.52-66-4):
Hazard Codes  HarmfulXn
Risk Statements  
R36/37/38:Irritating to eyes, respiratory system and skin. 
R40:Limited evidence of a carcinogenic effect. 
R20/21/22:Harmful by inhalation, in contact with skin and if swallowed.
Safety Statements  
S26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice. 
S36:Wear suitable protective clothing.
S22:Do not breathe dust. 
WGK Germany  3
RTECS  YV9445000