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Cas Database

Name

6-Bromobenzo[b]thiophene-2-carboxylic acid

EINECS

N/A

CAS No.

19075-58-2

Density

1.813g/cm³

PSA

65.54000

LogP

3.36200

Solubility

N/A

Melting Point

262-265

Formula

C9H5 Br O2 S

Boiling Point

429.7°Cat760mmHg

Molecular Weight

257.107

Flash Point

213.7°C

Transport Information

N/A

Appearance

N/A

Safety

Hazard Codes	Xi
Hazard Note	Irritant

Risk Codes

Xi:Irritant;

Molecular Structure

Hazard Symbols

Synonyms

6-Bromo-1-benzothiophene-2-carboxylicacid; 6-Bromobenzo[b]thiophene-2-carboxylic acid; 6-Bromobenzothiophene-2-carboxylicacid

Article Data

6-Bromobenzo[b]thiophene-2-carboxylic acid Chemical Properties

Product Name: 6-Bromobenzo[b]thiophene-2-carboxylic acid (CAS NO.19075-58-2)

Molecular Formula: C₉H₅BrO₂S
Molecular Weight: 257.10g/mol
Mol File: 19075-58-2.mol
Melting Point: 262-265
Index of Refraction: 1.739
Molar Refractivity: 57.1 cm³
Molar Volume: 141.743 cm³
Surface Tension: 67.904 dyne/cm
Density: 1.814 g/cm³
Flash Point: 213.652 °C
Enthalpy of Vaporization: 72.207 kJ/mol
Boiling Point: 429.662 °C at 760 mmHg
XLogP3-AA: 3.5
H-Bond Donor: 1
H-Bond Acceptor: 2
Structure Descriptors of 6-Bromobenzo[b]thiophene-2-carboxylic acid (CAS NO.19075-58-2):
IUPAC Name: 6-bromo-1-benzothiophene-2-carboxylic acid
Canonical SMILES: C1=CC2=C(C=C1Br)SC(=C2)C(=O)O
InChI: InChI=1S/C9H5BrO2S/c10-6-2-1-5-3-8(9(11)12)13-7(5)4-6/h1-4H,(H,11,12)
InChIKey: CKBBSFOOIOHLPC-UHFFFAOYSA-N

6-Bromobenzo[b]thiophene-2-carboxylic acid Safety Profile

Safety Information of 6-Bromobenzo[b]thiophene-2-carboxylic acid (CAS NO.19075-58-2):
Hazard Codes: Xi
Hazard Note: Irritant

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