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Dibenzothiophene-2,8-dicarbaldehyde

HCID 3448016
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Basic information

CAS
25185-91-5
Standard SMILES
O=Cc1ccc2sc3ccc(C=O)cc3c2c1
InChIKey
LFAGMIMSUYTWDN-UHFFFAOYSA-N
Molecular formula
C14H8O2S
Average molar mass
240.28 g/mol
Monoisotopic mass
240.02450067

Names & identifiers

Preferred name
Dibenzothiophene-2,8-dicarbaldehyde
IUPAC
dibenzothiophene-2,8-dicarbaldehyde
English name
Dibenzothiophene-2,8-dicarbaldehyde
Molecular formula
C14H8O2S
Molecular weight
240.27712

Names & synonyms

Dibenzothiophene-2,8-dicarbaldehydeRefChem:58641625185-91-5683-738-12,8-diformyl dibenzoth-iopheneSCHEMBL8720613SCHEMBL31083678AKOS002662603dibenzo[b,d]thiophene-2,8-dicarbaldehyde2,8-bis(formyl)dibenzothiophene2,8-Dibenzothiophenedicarboxaldehyde

Database identifiers

CAS
25185-91-5
PubChem CID
3448016
EC Number
683-738-1
Nikkaji
J2.833.175D

Properties

Computed structural properties

XLogP
3.2
Topological polar surface area
62.4 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
3
Rotatable bonds
2
Heavy atoms
17
Formal charge
0
Complexity
287

Physicochemical properties

Symbol(GHS)
7 · GHS07
Signal word
Warning
Hazard statements
319 · H319
Precautionary statements
264 · P264-P280-P305+P351+P338-P337+P313P

Safety & regulation

Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.

GHS classification

GHS Classification · 4 items

Warning

H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]

P264+P265, P280, P305+P351+P338, and P337+P317 (click each P-code to see the statement)

Aggregated GHS information provided per 38 reports by companies from 1 notifications to the ECHA C&L Inventory.

Hazard information

Hazard Classes and CategoriesEye Irrit. 2 (100%)

Safety data

Signal word
Warning
Symbol(GHS)
GHS07
Hazard statements
H319
Precautionary statements
P264-P280-P305+P351+P338-P337+P313P

Related reactions

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Compound notes

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