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3735-90-8

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Basic Information
CAS No.: 3735-90-8
Name: fencarbamide
Molecular Structure:
Molecular Structure of 3735-90-8 (fencarbamide)
Formula: C19H24 N2 O S
Molecular Weight: 328.478
Synonyms: Carbamicacid, diphenylthio-, S-[2-(diethylamino)ethyl] ester (7CI,8CI); Carbamothioicacid, diphenyl-, S-[2-(diethylamino)ethyl] ester (9CI); BAY 1355; Bayer 1355;Diphenylcarbamothioic acid S-[2-(diethylamino)ethyl] ester;Diphenylthiocarbamic acid S-[2-(diethylamino)ethyl] ester; Escorpal;Fencarbamide; Phencarbamid; Phencarbamide; Rispasulf; S-[2-(Diethylamino)ethyl]diphenylthiocarbamate
Density: 1.127g/cm3
Melting Point: 48-49°
Boiling Point: 441.8°Cat760mmHg
Flash Point: 221°C
Safety: Poison by ingestion, subcutaneous, and intravenous routes. When heated to decomposition it emits toxic fumes of SOx and NOx. See also CARBAMATES and ESTERS.
PSA: 48.85000
LogP: 5.01970
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Chemistry

Product Name: Phencarbamide [USAN]
CAS Registry Number: 3735-90-8
Synonyms: BAY 1355 ; BRN 2753271 ; Bayer 1355 ; Carbamothioic acid, diphenyl-, S-(2-(diethylamino)ethyl) ester ; Diphenylthiocarbamic acid S-(2-(diethylamino)ethyl) ester ; EINECS 223-103-4 ; Escorpal ; Fencarbamida ; Fencarbamida [INN-Spanish] ; Fencarbamide ; Fencarbamidum ; Fencarbamidum [INN-Latin] ; Phencarbamid ; Phencarbamide ; Rispasulf  ; S-(2-(Diethylamino)ethyl) diphenylthiocarbamate ; UNII-59H17J9F1B ; Carbamic acid, diphenylthio-, S-(2-(diethylamino)ethyl) ester 
IUPAC Name: S-(2-diethylaminoethyl) N,N-diphenylcarbamothioate 
Molecular Weight: 328.47166 [g/mol]
Molecular Formula: C19H24N2OS
XLogP3-AA: 4.6
H-Bond Acceptor: 2 
EINECS: 223-103-4
Surface Tension: 47.2 dyne/cm
Density: 1.127 g/cm3
Flash Point: 221 °C
Enthalpy of Vaporization: 69.92 kJ/mol
Boiling Point: 441.8 °C at 760 mmHg
Vapour Pressure: 5.27E-08 mmHg at 25°C
Following is the molecular structure of Phencarbamide [USAN] (CAS NO.3735-90-8) is:

Toxicity Data With Reference

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 32mg/kg (32mg/kg)   Archives Internationales de Pharmacodynamie et de Therapie. Vol. 155, Pg. 393, 1965.
mouse LD50 subcutaneous 93mg/kg (93mg/kg)   Archives Internationales de Pharmacodynamie et de Therapie. Vol. 155, Pg. 393, 1965.
rat LD50 intravenous 30mg/kg (30mg/kg)   Archives Internationales de Pharmacodynamie et de Therapie. Vol. 155, Pg. 393, 1965.
rat LD50 oral 370mg/kg (370mg/kg)   Archives Internationales de Pharmacodynamie et de Therapie. Vol. 155, Pg. 393, 1965.
rat LD50 subcutaneous 400mg/kg (400mg/kg)   Archives Internationales de Pharmacodynamie et de Therapie. Vol. 155, Pg. 393, 1965.

Safety Profile

Poison by ingestion, subcutaneous, and intravenous routes. When heated to decomposition it emits toxic fumes of SOx and NOx. See also CARBAMATES and ESTERS.

Specification

Descriptors computed from structure, you can know some information about Phencarbamide [USAN] (CAS NO.3735-90-8) :
Canonical SMILES: CCN(CC)CCSC(=O)N(C1=CC=CC=C1)C2=CC=CC=C2
InChI: InChI=1S/C19H24N2OS/c1-3-20(4-2)15-16-23-19(22)21(17-11-7-5-8-12-17)18-13-9-6-10-14-18/h5-14H,3-4,15-16H2,1-2H3
InChIKey: BZGIPVGCJGXQTA-UHFFFAOYSA-N