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CAS No.: | 19227-13-5 |
---|---|
Name: | 4-Methylbenzamide oxime |
Article Data: | 133 |
Molecular Structure: | |
Formula: | C8H10N2O |
Molecular Weight: | 150.18 |
Synonyms: | N-hydroxy-4-methyl-benzamidine;N-hydroxy-4-methyl-benzenecarboximidamide;p-Tolamidoxime;Benzenecarboximidamide, N-hydroxy-4-methyl-;p-Toluamidoxime;p-Toluamide oxime; |
Density: | 1.15 g/cm3 |
Melting Point: | 140-145 °C(lit.) |
Boiling Point: | 258.052 °C at 760 mmHg |
Flash Point: | 109.866 °C |
Hazard Symbols: | Xi |
Risk Codes: | 36/37/38 |
Safety: | 26-36 |
PSA: | 58.61000 |
LogP: | 1.78980 |
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IUPAC Name: N'-hydroxy-4-methylbenzenecarboximidamide
Molecular Formula: C8H10N2O
Molecular Weight: 150.18 g/mol
Canonical SMILES: CC1=CC=C(C=C1)C(=NO)N
InChI: InChI=1S/C8H10N2O/c1-6-2-4-7(5-3-6)8(9)10-11/h2-5,11H,1H3,(H2,9,10)
Mol File: 19227-13-5.mol
Product Categories: Oxime; pharmacetical
XLogP3: 1.4
H-Bond Donor: 2
H-Bond Acceptor: 3
Rotatable Bond Count: 1
Tautomer Count: 7
Exact Mass: 150.079313
MonoIsotopic Mass: 150.079313
Topological Polar Surface Area: 58.6
Heavy Atom Count: 11
Complexity: 148
Index of Refraction: 1.564
Molar Refractivity: 42.49 cm3
Molar Volume: 130.6 cm3
Polarizability: 16.84×10-24cm3
Surface Tension: 42.5 dyne/cm
Density: 1.14 g/cm3
Flash Point: 144 °C
Enthalpy of Vaporization: 58.66 kJ/mol
Boiling Point: 314.4 °C at 760 mmHg
Melting Point: 140-145 °C(lit.)
Vapour Pressure of 4-Methylbenzamide oxime (CAS NO.19227-13-5): 0.000198 mmHg at 25 °C
Organism | Test Type | Route | Reported Dose (Normalized Dose) | Effect | Source |
---|---|---|---|---|---|
mouse | LD50 | intravenous | 180mg/kg (180mg/kg) | U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. Vol. NX#04182, |
Hazard Codes: Xi
Risk Statements: 36/37/38
R36/37/38: Irritating to eyes, respiratory system and skin.
Safety Statements: 26-36
S26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.
S36: Wear suitable protective clothing.
WGK Germany: 3
RTECS: XS4870000
Hazard Note: Irritant
HazardClass of 4-Methylbenzamide oxime (CAS NO.19227-13-5): Irritant
4-Methylbenzamide oxime (CAS NO.19227-13-5), its Synonyms are 4-Methylbenzamidoxime ; Benzenecarboximidamide, N-hydroxy-4-methyl- ; p-Tolamidoxime ; p-Toluamide oxime ; p-Toluamidoxime ; N'-hydroxy-4-Methylbenzenecarboximidamide ; BUTTPARK33\11-54 ; ART-CHEM-BB B022751 .