CAS 22099-23-6 Dibenzo(b,d)thiophene-2-carbaldehyde (HCID 641360)

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Basic information

CAS: 22099-23-6
Standard SMILES: O=Cc1ccc2sc3ccccc3c2c1
InChIKey: QFGXAEFJJINHAI-UHFFFAOYSA-N
Molecular formula: C13H8OS
Average molar mass: 212.27 g/mol
Monoisotopic mass: 212.02958588

Names & identifiers

Preferred name: Dibenzo(b,d)thiophene-2-carbaldehyde
IUPAC: dibenzothiophene-2-carbaldehyde
English name: Dibenzothiophene-2-carboxaldehyde
Molecular formula: C13H8OS
Molecular weight: 212.27

Names & synonyms

dibenzo[b,d]thiophene-2-carbaldehyde22099-23-6DTXSID40348892dibenzo[b,d]thiophene-2-carboxaldehydeDibenzo(b,d)thiophene-2-carbaldehydedibenzo(b,d)thiophene-2-carboxaldehydeRefChem:337068DTXCID70299964InChI=1/C13H8OS/c14-8-9-5-6-13-11(7-9)10-3-1-2-4-12(10)15-13/h1-8Dibenzothiophene-2-carboxaldehydedibenzothiophene-2-carbaldehyde2-Dibenzothiophenecarboxaldehyde

Show more names

Dibenzothiophene-2-carboxaldehyde>dibenzenebenzothiophene-2-methylaldehyde

MFCD02251670XAA09923D4777EN300-7059108-thiatricyclo[7.4.0.0(2),?]trideca-1(9),2(7),3,5,10,12-hexaene-4-carbaldehydeZ1509539328orb3022940SCHEMBL6860177

Database identifiers

CAS: 22099-23-6
PubChem CID: 641360
DTXSID: DTXSID40348892
Nikkaji: J2.810.008F

Properties

Computed structural properties

XLogP: 3.8
Topological polar surface area: 45.3 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 2
Rotatable bonds: 1
Heavy atoms: 15
Formal charge: 0
Complexity: 253

Physicochemical properties

Melting point: 105 to · 105.0 to 109.0 °C
Boiling point: 403.6 · 403.6±18.0 °C(Predicted)
Density: 1.336 · 1.336±0.06 g/cm3(Predicted)
storage temp.: Inert atmosphere,Room Temperature
form: powder to crystaline
color: White to Orange to Green
CAS DataBase Reference: 22099 · 22099-23-6
Symbol(GHS): 5 · GHS05,GHS02
Signal word: Danger
Hazard statements: 314 · H314-H226-H290
Precautionary statements: 501 · P501-P240-P210-P233-P234-P243-P241-P242-P264-P280-P370+P378-P390-P303+P361+P353-P301+P330+P331-P363-P304+P340+P310-P305+P351+P338+P310-P403+P235-P406-P405
HS Code: 2934.99 · 2934.99.4400

Safety & regulation

Safety data

hs_code: 2934.99.4400
Signal word: Danger
Symbol(GHS): GHS05,GHS02
Hazard statements: H314-H226-H290
Precautionary statements: P501-P240-P210-P233-P234-P243-P241-P242-P264-P280-P370+P378-P390-P303+P361+P353-P301+P330+P331-P363-P304+P340+P310-P305+P351+P338+P310-P403+P235-P406-P405

Chemistry & industry

Applications

UsesDibenzothiophene-2-carboxaldehyde is used as a mosquito larvicide.

Suppliers56 total

梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]

山东旭晨化工科技有限公司0533-15715337262 15715337262 · [email protected]

山东普创医药科技有限公司18953403321 · [email protected]

上海麦克林生化科技股份有限公司021-50706066 15221275939 · [email protected]

上海仲因实业有限公司2537653158 16621191650 · [email protected]

Related reactions

2 records

New reaction record

HRID 594284As productuspto-grants-2016_01

HRID 594749As reactantuspto-grants-2016_01

Compound notes

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