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Basic Information
CAS No.: 3772-76-7
Name: sulfametomidine
Molecular Structure:
Molecular Structure of 3772-76-7 (sulfametomidine)
Formula: C12H14 N4 O3 S
Molecular Weight: 294.334
Synonyms: Sulfanilamide,N1-(6-methoxy-2-methyl-4-pyrimidinyl)- (6CI,8CI); Sulfanilamide, N1-(6-methoxy-2-methyl-4-pyrimidinyl)-(7CI); 4-Methoxy-2-methyl-6-sulfanilamidopyrimidine; Duroprocin; Methofadin;Methofazine; N1-(6-Methoxy-2-methyl-4-pyrimidinyl)sulfanilamide;Sulfamethomidine; Sulfametomidine; Telemid
Density: 1.418g/cm3
Melting Point: 146°
Boiling Point: 501.6°Cat760mmHg
Flash Point: 257.2°C
Solubility: 843mg/L(temperature not stated)
Safety: Poison by intravenous route. Experimental reproductive effects. An experimental teratogen. When heated to decomposition it emits toxic fumes of SOx and NOx.
PSA: 115.58000
LogP: 2.91160
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Chemistry

Product Name: Sulfametomidine (CAS NO.3772-76-7)


Molecular Formula: C12H14N4O3S
Molecular Weight: 294.36g/mol
Mol File: 3772-76-7 .mol
Einecs: 223-219-5
Boiling point: 501.6 °C at 760 mmHg
Flash Point: 257.2 °C
Density: 1.418 g/cm3
Surface Tension: 70.4 dyne/cm
Enthalpy of Vaporization: 77.05 kJ/mol
Vapour Pressure: 3.42E-10 mmHg at 25°C
XLogP3-AA: 0.6
H-Bond Donor: 2
H-Bond Acceptor: 7
Structure Descriptors of Sulfametomidine (CAS NO.3772-76-7):
  IUPAC Name: 4-amino-N-(6-methoxy-2-methylpyrimidin-4-yl)benzenesulfonamide
  Canonical SMILES: CC1=NC(=CC(=N1)OC)NS(=O)(=O)C2=CC=C(C=C2)N
  InChI: InChI=1S/C12H14N4O3S/c1-8-14-11(7-12(15-8)19-2)16-20(17,18)10-5-3-9(13)4-6-10/h3-7H,13H2,1-2H3,(H,14,15,16) 
  InChIKey: QKLSCPPJEVXONT-UHFFFAOYSA-N

Toxicity Data With Reference

1.    

ivn-mus LD50:16 mg/kg

     ARZNAD    Arzneimittel-Forschung. Drug Research. 3 (1953),66.

Safety Profile

Poison by intravenous route. Experimental reproductive effects. An experimental teratogen. When heated to decomposition it emits toxic fumes of SOx and NOx.

Specification

 Sulfametomidine ,its CAS NO. is 3772-76-7 ,the synonyms is (p-Aminobenzolsulfonyl)-4-amino-2-methyl-6-methoxy-pyrimidin ; 4-Amino-N-(6-methoxy-2-methyl-4-pyrimidinyl)benzenesulfonamide ; 4-Sulfanilamido-6-methoxy-2-methylpyrimidin ; 5-25-13-00006 (Beilstein Handbook Reference) ; BRN 0284949 ; Duroprocin ; EINECS 223-219-5 ; Methofadin ; Methofazine ; N(sup 1)-(6-Methoxy-2-methyl-4-pyrimidinyl)sulfanilamide ; N1-(6-Methoxy-2-methyl-4-pyrimidinyl)sulfanilamid ; SA 412 ; Sulfametomidinum ; UNII-940ZL3AHKB ; Benzenesulfonamide, 4-amino-N-(6-methoxy-2-methyl-4-pyrimidinyl)- (9CI) ; N1-(6-Methoxy-2-methyl-4-pyrimidinyl)sulfanilamide ; Sulfanilamide, N(sup 1)-(6-methoxy-2-methyl-4-pyrimidinyl)- .