1,3-Benzodioxol-4-amine,6-methoxy- supplier

Name
1,3-Benzodioxol-4-amine,6-methoxy-(9CI)
EINECS
CAS No. 401811-81-2
Density 1.317 g/cm³
Solubility
Melting Point
Formula C₈H₉NO₃
Boiling Point 293.814 °C at 760 mmHg
Molecular Weight 167.163
Flash Point 152.407 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 5-Methoxy-2,3-methylenedioxyaniline;6-Methoxy-1,3-benzodioxol-4-amine;6-methoxy-2H-benzo[d]1,3-dioxolane-4-ylamine;
PSA 53.71000
LogP 1.58730

1,3-Benzodioxol-4-amine,6-methoxy- Specification

The CAS register number of 1,3-Benzodioxol-4-amine,6-methoxy- is 401811-81-2. It also can be called as 6-methoxy-2H-benzo[d]1,3-dioxolane-4-ylamine and the systematic name about this chemical is 6-methoxy-1,3-benzodioxol-4-amine. The molecular formula about this chemical is C₈H₉NO₃ and the molecular weight is 167.163. It belongs to the Methoxy.

Physical properties about 1,3-Benzodioxol-4-amine,6-methoxy- are: (1)ACD/LogP: 0.76; (2)ACD/LogD (pH 5.5): 1; (3)ACD/LogD (pH 7.4): 1; (4)ACD/BCF (pH 5.5): 2; (5)ACD/BCF (pH 7.4): 2; (6)ACD/KOC (pH 5.5): 61; (7)ACD/KOC (pH 7.4): 62; (8)#H bond acceptors: 4; (9)#H bond donors: 2; (10)#Freely Rotating Bonds: 2; (11)Polar Surface Area: 53.71Å²; (12)Index of Refraction: 1.599; (13)Molar Refractivity: 43.329 cm³; (14)Molar Volume: 126.894 cm³; (15)Polarizability: 17.177x10^-24cm³; (16)Surface Tension: 54.729 dyne/cm; (17)Flash Point: 152.407 °C; (18)Enthalpy of Vaporization: 53.341 kJ/mol; (19)Boiling Point: 293.814 °C at 760 mmHg; (20)Vapour Pressure: 0.002 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: COc1cc2OCOc2c(N)c1
(2)InChI: InChI=1/C8H9NO3/c1-10-5-2-6(9)8-7(3-5)11-4-12-8/h2-3H,4,9H2,1H3
(3)InChIKey: GZZUZOJGSXXWIS-UHFFFAOYAF
(4)Std. InChI: InChI=1S/C8H9NO3/c1-10-5-2-6(9)8-7(3-5)11-4-12-8/h2-3H,4,9H2,1H3
(5)Std. InChIKey: GZZUZOJGSXXWIS-UHFFFAOYSA-N

Product Name

1,3-Benzodioxol-4-amine,6-methoxy-(9CI)

1,3-Benzodioxol-4-amine,6-methoxy- Specification

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