Benzo[b]thiophen-6-amine,1,1-dioxide supplier

Name
6-AMINO-1H-1LAMBDA6-BENZO[B]THIOPHENE-1,1-DIONE
EINECS
CAS No. 20503-40-6
Article Data2
CAS DataBase
Density 1.501 g/cm³
Solubility
Melting Point 150 °C
Formula C₈H₇NO₂S
Boiling Point 467.4 °C at 760 mmHg
Molecular Weight 181.215
Flash Point 236.5 °C
Transport Information
Appearance
Safety 26-36/37/39
Risk Codes 36/37/38
Molecular Structure
Hazard Symbols Xi
Synonyms (1,1-Dioxobenzothiophen-6-yl)amine;1,1-Dioxo-1H-benzo[b]thiophen-6-ylamine;6-Amino-1,1-dioxobenzo[b]thiophene;6-Aminobenzo[b]thiophene 1,1-dioxide;6-Aminobenzothiophene-1,1-dioxide;
PSA 68.54000
LogP 2.68880

Benzo[b]thiophen-6-amine,1,1-dioxide Specification

The Benzo[b]thiophen-6-amine,1,1-dioxide, with the CAS registry number 20503-40-6, is also known as 6-Amino-1,1-Dioxobenzo[B]Thiophene. This chemical's molecular formula is C₈H₇NO₂S and molecular weight is 181.2117. Its systematic name is called 1-benzothiophen-6-amine 1,1-dioxide.

Physical properties of Benzo[b]thiophen-6-amine,1,1-dioxide: (1)ACD/LogP: 0.25; (2)ACD/LogD (pH 5.5): 0.25; (3)ACD/LogD (pH 7.4): 0.25; (4)ACD/BCF (pH 5.5): 1; (5)ACD/BCF (pH 7.4): 1; (6)ACD/KOC (pH 5.5): 32.68; (7)ACD/KOC (pH 7.4): 32.69; (8)#H bond acceptors: 3; (9)#H bond donors: 2; (10)#Freely Rotating Bonds: 1; (11)Index of Refraction: 1.693; (12)Molar Refractivity: 46.3 cm³; (13)Molar Volume: 120.6 cm³; (14)Surface Tension: 65.4 dyne/cm; (15)Density: 1.501 g/cm³; (16)Flash Point: 236.5 °C; (17)Enthalpy of Vaporization: 72.93 kJ/mol; (18)Boiling Point: 467.4 °C at 760 mmHg; (19)Vapour Pressure: 6.55E-09 mmHg at 25°C.

When you are using this chemical, please be cautious about it as the following:
This chemical may cause inflammation to the skin or other mucous membranes. It is irritating to eyes, respiratory system and skin. In case of contact with eyes, you should rinse immediately with plenty of water and seek medical advice. Whenever you will contact it, please wear suitable protective clothing, gloves and eye/face protection.

You can still convert the following datas into molecular structure:
(1)SMILES: O=S/2(=O)c1cc(ccc1\C=C\2)N
(2)InChI: InChI=1/C8H7NO2S/c9-7-2-1-6-3-4-12(10,11)8(6)5-7/h1-5H,9H2
(3)InChIKey: KRUCRVZSHWOMHC-UHFFFAOYAP

Product Name

6-AMINO-1H-1LAMBDA6-BENZO[B]THIOPHENE-1,1-DIONE

Benzo[b]thiophen-6-amine,1,1-dioxide Specification

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