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637-58-1

Basic Information
CAS No.: 637-58-1
Name: Pramoxine hydrochloride
Molecular Structure:
Molecular Structure of 637-58-1 (Pramoxine hydrochloride)
Formula: C17H28ClNO3
Molecular Weight: 329.87
Synonyms: Morpholine,4-[3-(4-butoxyphenoxy)propyl]-, hydrochloride (9CI);Morpholine, 4-[3-(p-butoxyphenoxy)propyl]-,hydrochloride (7CI,8CI);Pramoxine hydrochloride (6CI);4-[3-(p-Butoxyphenoxy)propyl]morpholine hydrochloride;Pramocainehydrochloride;Proctofoam;Tronolaine;Tronothan;Tronothane;Tronothanehydrochloride;
EINECS: 211-293-1
Density:
Melting Point: 181-183oC
Boiling Point: 427 °C at 760 mmHg
Flash Point: 123.5 °C
Solubility:
Appearance: White or off white crystalline powder
Hazard Symbols: IrritantXi, HarmfulXn
Risk Codes: 22-36/37/38
Safety: 26-36
Transport Information:
PSA: 30.93000
LogP: 3.70650
Synthetic route
4441-30-9

3-morpholin-4-ylpropan-1-ol

39969-57-8

1-bromo-4-butoxybenzene

637-58-1

pramoxine hydrochloride

Conditions
ConditionsYield
With sodium hydride In tetrahydrofuran at 20℃; for 5h; Reflux;82.61%
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    Product Description Pramoxine Hydrochloride English name: Pramoxine Hydrochloride English Name: 4- (3- (p-butoxyphenoxy) propyl) -morpholinhydrochloride; Gamma-morpholinopropyl4-n-butoxyphenyletherhydrochloride; P-butoxyphenylgamma-morpholinopr

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Specification

The Pramoxine hydrochloride, with the CAS registry number 637-58-1,is also known as 4-n-Butoxyphenyl gamma-morpholinopropyl ether hydrochloride. It belongs to the product categories of Organic matters.Its EINECS number is 211-293-1. This chemical's molecular formula is C17H27NO3.HCl and molecular weight is 329.87. What's more,Its systematic name is Pramocaine hydrochloride.The Pramoxine hydrochloride is harmful if swallowed and irritating to eyes, respiratory system and skin.When you use it ,wear suitable protective clothing .In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.

Physical properties about Pramoxine hydrochloride are:
(1)ACD/LogP:  3.477; (2)# of Rule of 5 Violations:  0; (3)ACD/LogD (pH 5.5):  1.52; (4)ACD/LogD (pH 7.4):  3.13; (5)ACD/BCF (pH 5.5):  2.85; (6)ACD/BCF (pH 7.4):  116.77; (7)ACD/KOC (pH 5.5):  20.48; (8)ACD/KOC (pH 7.4):  838.17; (9)#H bond acceptors:  4; (10)#H bond donors:  0; (11)#Freely Rotating Bonds:  9; (12)Flash Point:  123.5 °C; (13)Enthalpy of Vaporization:  68.19 kJ/mol ; (14)Boiling Point:  427 °C at 760 mmHg; (15)Vapour Pressure:  1.7E-07 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES:Cl.O(c2ccc(OCCCN1CCOCC1)cc2)CCCC;
(2)Std. InChI:InChI=1S/C17H27NO3.ClH/c1-2-3-12-20-16-5-7-17(8-6-16)21-13-4-9-18-10-14-19-15-11-18;/h5-8H,2-4,9-15H2,1H3;1H;
(3)Std. InChIKey:SYCBXBCPLUFJID-UHFFFAOYSA-N.

The toxicity data of Pramoxine hydrochloride are as follows:

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
guinea pig LDLo intravenous 109mg/kg (109mg/kg) BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD

CARDIAC: CARDIAC OUTPUT

LUNGS, THORAX, OR RESPIRATION: OTHER CHANGES
Anesthesie, Analgesie, Reanimation. Vol. 14, Pg. 225, 1957.
mouse LD50 intraperitoneal 460mg/kg (460mg/kg)   "Handbook of Analytical Toxicology," Sunshine, I., ed., Cleveland, OH, Chemical Rubber Co., 1969Vol. -, Pg. 99, 1969.
mouse LD50 intravenous 79500ug/kg (79.5mg/kg)   Toxicology and Applied Pharmacology. Vol. 1, Pg. 454, 1959.
mouse LD50 oral 1050mg/kg (1050mg/kg)   "Handbook of Analytical Toxicology," Sunshine, I., ed., Cleveland, OH, Chemical Rubber Co., 1969Vol. -, Pg. 99, 1969.
mouse LD50 subcutaneous 1470mg/kg (1470mg/kg) CARDIAC: CARDIAC OUTPUT

BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD

LUNGS, THORAX, OR RESPIRATION: OTHER CHANGES
Anesthesie, Analgesie, Reanimation. Vol. 14, Pg. 225, 1957.
rabbit LD50 intravenous 39mg/kg (39mg/kg)   "Handbook of Analytical Toxicology," Sunshine, I., ed., Cleveland, OH, Chemical Rubber Co., 1969Vol. -, Pg. 99, 1969.