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Basic Information
CAS No.: 12771-68-5
Name: Ancymidol
Molecular Structure:
Molecular Structure of 12771-68-5 (Ancymidol)
Formula: C15H16N2O2
Molecular Weight: 256.304
Synonyms: 5-Pyrimidinemethanol,a-cyclopropyl-a-(p-methoxyphenyl)- (8CI);A-Rest;EL 531;Reducymol;Thritone;a-Cyclopropyl-a-(4-methoxyphenyl)-5-pyrimidinemethanol;a-Cyclopropyl-a-(4-methoxyphenyl)-5-pyrimidinylmethanol;a-Cyclopropyl-a-(methoxyphenyl)-5-pyrimidinemethanol;
EINECS: 235-814-7
Density: 1.26 g/cm3
Melting Point: 110-111 °C
Boiling Point: 442.183 °C at 760 mmHg
Flash Point: 221.225 °C
Solubility: 0.65g/L(25 oC)
Appearance: White to yellow powder
Safety: 22-24/25
PSA: 55.24000
LogP: 2.13110
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Conditions
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With n-butyllithium In tetrahydrofuran; hexane at -95 - 20℃;43%
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Conditions
ConditionsYield
With lithium chloride; zinc(II) chloride In tetrahydrofuran at 20℃; for 4h;31%
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Conditions
ConditionsYield
Multi-step reaction with 3 steps
1.1: zinc; iodine; lithium chloride / ethylene dibromide / tetrahydrofuran / 6 h / 20 °C / Reflux
1.2: 0.17 h / 20 °C
2.1: potassium permanganate / ethyl acetate; water / 12 h / 20 °C
3.1: lithium chloride; zinc(II) chloride / tetrahydrofuran / 4 h / 20 °C
View Scheme
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Conditions
ConditionsYield
Multi-step reaction with 2 steps
1: potassium permanganate / ethyl acetate; water / 12 h / 20 °C
2: lithium chloride; zinc(II) chloride / tetrahydrofuran / 4 h / 20 °C
View Scheme
12771-68-5

ancymidole

(+)-ancymidol

(-)-ancymidol

Conditions
ConditionsYield
With Lux Cellulose-2 (cellulose tris-(3-chloro-4-methylphenylcarbamate) In hexane; isopropyl alcohol at 20℃; Thermodynamic data; Reagent/catalyst; Temperature; Resolution of racemate;
Raw Materials
23719-80-4
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Chemistry

IUPAC Name: Cyclopropyl-(4-methoxyphenyl)-pyrimidin-5-yl-methanol
The MF of Ancymidol (CAS NO.12771-68-5) is C15H16N2O2.

                      
The MW of Ancymidol (CAS NO.12771-68-5) is 256.3.
Synonyms of Ancymidol (CAS NO.12771-68-5): 5-Pyrimidinemethanol, .alpha.-cyclopropyl-.alpha.-(4-methoxyphenyl)- ; a-Cyclopropyl-a-(4-methoxyphenyl)-5-pyrimidinemethanol
Index of Refraction: 1.618 
Density: 1.259 g/ml 
Flash Point: 221.2 °C
Boiling Point: 442.2 °C
Melting Point: 110-111 °C
Storage temp:  2-8 °C
EINECS: 235-814-7

Uses

  Ancymidol (CAS NO.12771-68-5) is used as Synthetic plant growth regulators and inhibitors.

Toxicity Data With Reference

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
chicken LD50 oral > 500mg/kg (500mg/kg)   Pesticide Manual. Vol. 9, Pg. 34, 1991.
dog LD50 oral > 500mg/kg (500mg/kg)   Pesticide Manual. Vol. 9, Pg. 34, 1991.
monkey LD50 oral > 500mg/kg (500mg/kg)   Pesticide Manual. Vol. 9, Pg. 34, 1991.
mouse LD50 intraperitoneal 500mg/kg (500mg/kg) BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY)

BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD		 Nippon Noyaku Gakkaishi. Journal of the Pesticide Science Society of Japan. Vol. 17, Pg. S151, 1992.
mouse LD50 oral 5gm/kg (5000mg/kg)   Pesticide Manual. Vol. 9, Pg. 34, 1991.
mouse LD50 subcutaneous > 10gm/kg (10000mg/kg)   Nippon Noyaku Gakkaishi. Journal of the Pesticide Science Society of Japan. Vol. 17, Pg. S151, 1992.
rabbit LD50 skin > 200mg/kg (200mg/kg)   Farm Chemicals Handbook. Vol. -, Pg. C26, 1991.
rat LCLo inhalation > 5600mg/m3/4H (5600mg/m3)   Pesticide Manual. Vol. 9, Pg. 34, 1991.
rat LD50 intraperitoneal 780mg/kg (780mg/kg) BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY)

BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD		 Nippon Noyaku Gakkaishi. Journal of the Pesticide Science Society of Japan. Vol. 17, Pg. S151, 1992.
rat LD50 oral 4500mg/kg (4500mg/kg)   Farm Chemicals Handbook. Vol. -, Pg. C26, 1991.
rat LD50 subcutaneous > 10gm/kg (10000mg/kg)   Nippon Noyaku Gakkaishi. Journal of the Pesticide Science Society of Japan. Vol. 17, Pg. S151, 1992.

Safety Profile

Safety information of Ancymidol (CAS NO.12771-68-5):
Safety Statements 
22 Do not breathe dust
24/25 Avoid contact with skin and eyes
WGK Germany  3
RTECS  UV9280000