Benzenecarboximidamide,3-amino-N-hydroxy- supplier

Name
3-AMINO-BENZAMIDE OXIME
EINECS
CAS No. 100524-07-0
Article Data5
CAS DataBase
Density 1.348 g/cm³
Solubility
Melting Point 101-105℃
Formula C₇H₉N₃O
Boiling Point 413.798 °C at 760 mmHg
Molecular Weight 151.168
Flash Point 204.058 °C
Transport Information
Appearance
Safety 26-36/37/39-45
Risk Codes 25-36/37/38
Molecular Structure
Hazard Symbols T
Synonyms Benzamidoxime,m-amino- (6CI);3-Amino-N-hydroxybenzenecarboximidamide;3-Amino-benzamide oxime;
PSA 84.63000
LogP 1.64480

Benzenecarboximidamide,3-amino-N-hydroxy- Specification

The CAS register number of Benzenecarboximidamide,3-amino-N-hydroxy- is 100524-07-0. It also can be called as 3-Amino-benzamide oxime and the IUPAC name about this chemical is 3-amino-N'-hydroxybenzenecarboximidamide. The molecular formula about this chemical is C₇H₉N₃O and the molecular weight is 151.17.

Physical properties about Benzenecarboximidamide,3-amino-N-hydroxy- are: (1)ACD/LogP: -0.22; (2)# of Rule of 5 Violations: 1; (3)ACD/BCF (pH 5.5): 1; (4)ACD/BCF (pH 7.4): 1; (5)ACD/KOC (pH 5.5): 22; (6)ACD/KOC (pH 7.4): 29; (7)#H bond acceptors: 4; (8)#H bond donors: 5; (9)#Freely Rotating Bonds: 3; (10)Polar Surface Area: 84.63 Å²; (11)Index of Refraction: 1.632; (12)Molar Refractivity: 39.988 cm³; (13)Molar Volume: 112.161 cm³; (14)Polarizability: 15.853x10^-24cm³; (15)Surface Tension: 58.029 dyne/cm; (16)Density: 1.348 g/cm³; (17)Flash Point: 204.058 °C; (18)Enthalpy of Vaporization: 70.287 kJ/mol; (19)Boiling Point: 413.798 °C at 760 mmHg.

You can still convert the following datas into molecular structure:
(1)SMILES: Nc1cc(ccc1)C(\N)=N\O
(2)InChI: InChI=1/C7H9N3O/c8-6-3-1-2-5(4-6)7(9)10-11/h1-4,11H,8H2,(H2,9,10)
(3)InChIKey: OPGWBTKZYLRPRW-UHFFFAOYAN
(4)Std. InChI: InChI=1S/C7H9N3O/c8-6-3-1-2-5(4-6)7(9)10-11/h1-4,11H,8H2,(H2,9,10)
(5)Std. InChIKey: OPGWBTKZYLRPRW-UHFFFAOYSA-N

Product Name

3-AMINO-BENZAMIDE OXIME

Benzenecarboximidamide,3-amino-N-hydroxy- Specification

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