Products Categories
| CAS No.: | 7312-24-5 |
|---|---|
| Name: | 5-BROMOBENZO[B]THIOPHENE-3-CARBOXYLIC ACID |
| Article Data: | 2 |
| Molecular Structure: | |
|
|
|
| Formula: | C9H5BrO2S |
| Molecular Weight: | 257.107 |
| Synonyms: | 5-Bromobenzo[b]thiophene-3-carboxylicacid;5-Bromobenzothiophene-3-carboxylic acid; |
| Density: | 1.814 g/cm3 |
| Melting Point: | 284 °C |
| Boiling Point: | 429.662 °C at 760 mmHg |
| Flash Point: | 213.652 °C |
| Risk Codes: | 22-36/37/38 |
| Safety: | 22-26-36/37/39 |
| PSA: | 65.54000 |
| LogP: | 3.36200 |
- 81281-59-67-Benzylideneaminotheophylline
- 82993-81-5D-threo-Ritalinic acid hydrochloride
- 73441-42-6METHYL-5-CHLORO-2,2-DIMETHYLVALERATE
- 852475-26-4MC1568
- 958254-66-51H-Imidazo[4,5-b]pyridine-2-carboxaldehyde, 1-methyl-, hydrochloride
- 99170-93-1N-Methyl-2-oxazolamine
- 914458-26-7[5-(2-fluorophenyl)-1-pentyl-1H-pyrrol-3-yl]-1-naphthalenyl-Methanone
- 894852-01-87-BROMO-2,2-DIMETHYL-2H-PYRIDO[3,2-B][1,4]OXAZIN-3(4H)-ONE
- 90221-55-92-bromo-5-methylbenzaldehyde
- 885590-99-82,3-DIFLUORO-4-IODOBENZALDEHYDE
- Total:27 Page 1 of 1 1
What can I do for you?
Get Best Price
Specification
This chemical is called 5-Bromobenzothiophene-3-carboxylic acid, and its systematic name is 5-bromo-1-benzothiophene-3-carboxylic acid. With the molecular formula of C9H5BrO2S, its molecular weight is 257.10. The CAS registry number of this chemical is 7312-24-5. Additionally, its product categories are Carboxylic Acids; Thiophenes & Benzothiophenes.
Other characteristics of the 5-Bromobenzothiophene-3-carboxylic acid can be summarised as followings: (1)ACD/LogP: 3.11; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 0.802 ; (4)ACD/BCF (pH 5.5): 1; (5)ACD/BCF (pH 7.4): 1; (6)ACD/KOC (pH 5.5): 5.774; (7)ACD/KOC (pH 7.4): 1; (8)#H bond acceptors: 2; (9)#H bond donors: 1; (10)#Freely Rotating Bonds: 1; (11)Polar Surface Area: 65.54 Å2; (12)Index of Refraction: 1.739; (13)Molar Refractivity: 57.1 cm3; (14)Molar Volume: 141.743 cm3; (15)Polarizability: 22.636×10-24cm3; (16)Surface Tension: 67.904 dyne/cm; (17)Density: 1.814 g/cm3; (18)Flash Point: 213.652 °C; (19)Enthalpy of Vaporization: 72.207 kJ/mol; (20)Boiling Point: 429.662 °C at 760 mmHg; (21)Vapour Pressure: 0 mmHg at 25°C.
You can still convert the following datas into molecular structure:
1.SMILES: c1cc2c(cc1Br)c(cs2)C(=O)O
2.InChI: InChI=1/C9H5BrO2S/c10-5-1-2-8-6(3-5)7(4-13-8)9(11)12/h1-4H,(H,11,12)
3.InChIKey: DWQBOPASRUUSKR-UHFFFAOYAM