1-Benzothiophene-3-carbaldehyde supplier

Name
1-Benzothiophene-3-carbaldehyde
EINECS 611-051-9
CAS No. 5381-20-4
Article Data29
CAS DataBase
Density 1.3 g/cm³
Solubility
Melting Point 53-57 °C(lit.)
Formula C₉H₆OS
Boiling Point 303.2 °C at 760 mmHg
Molecular Weight 162.212
Flash Point 137.2 °C
Transport Information
Appearance yellow to brown crystalline powder
Safety
Risk Codes
Molecular Structure
Hazard Symbols Xi
Synonyms 1-Benzothiophene-3-carboxaldehyde;3-Benzothiophenecarboxaldehyde;3-Formylbenzo[b]thiophene;3-Thianaphthenecarboxaldehyde;Benzo[b]thiophene-3-aldehyde;Thianaphtene-3-carboxaldehyde;
PSA 45.31000
LogP 2.71380

1-Benzothiophene-3-carbaldehyde Chemical Properties

IUPAC Name: 1-Benzothiophene-3-carbaldehyde
Molecular Formula: C₉H₆OS
Molecular Weight: 162.21 g/mol
Canonical SMILES: C1=CC=C2C(=C1)C(=CS2)C=O
InChI: InChI=1S/C9H6OS/c10-5-7-6-11-9-4-2-1-3-8(7)9/h1-6H
Product Categories: Pharmaceutical Intermediates; Heterocycles; Heterocyclic Compound
XLogP3: 2.6
H-Bond Acceptor: 1
Rotatable Bond Count: 1
Exact Mass: 162.013936
MonoIsotopic Mass: 162.013936
Topological Polar Surface Area: 17.1
Heavy Atom Count: 11
Complexity: 158
Melting Point: 53-57 °C(lit.)
Index of Refraction: 1.719
Molar Refractivity: 49.23 cm³
Molar Volume: 124.6 cm³
Polarizability: 19.51×10^-24 cm³
Surface Tension: 54.8 dyne/cm
Density: 1.3 g/cm³
Flash Point: 137.2 °C
Enthalpy of Vaporization: 54.35 kJ/mol
Boiling Point: 303.2 °C at 760 mmHg
Vapour Pressure of 1-Benzothiophene-3-carbaldehyde (CAS NO.5381-20-4): 0.000944 mmHg at 25 °C

1-Benzothiophene-3-carbaldehyde Safety Profile

Hazard Codes: Xi
WGK Germany: 3
Hazard Note of 1-Benzothiophene-3-carbaldehyde (CAS NO.5381-20-4): Irritant

1-Benzothiophene-3-carbaldehyde Specification

1-Benzothiophene-3-carbaldehyde (CAS NO.5381-20-4), its Synonyms are Thianaphthene-3-carboxaldehyde ; 1-Benzothiophene-3-carboxaldehyde ; Benzo[B]Thiophene-3-Carboxalde . It is yellow to brown crystalline powder.

Product Name

1-Benzothiophene-3-carbaldehyde

1-Benzothiophene-3-carbaldehyde Chemical Properties

1-Benzothiophene-3-carbaldehyde Safety Profile

1-Benzothiophene-3-carbaldehyde Specification

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