Basic information
- CAS
63786-62-9- Standard SMILES
O=C1C(c2nc3ccccc3[nH]2)=C(O)c2ccccc21- InChIKey
WHSAAXAZFCTCNG-UHFFFAOYSA-N- Molecular formula
- C16H10N2O2
- Average molar mass
- 262.26 g/mol
- Monoisotopic mass
- 262.07422757
Names & identifiers
- Preferred name
- 2-(1,3-Dihydro-benzoimidazol-2-ylidene)-indan-1,3-dione
- IUPAC
- 2-(1H-benzimidazol-2-yl)-3-hydroxyinden-1-one
- English name
- 2-(3-Hydrobenzimidazol-2-ylidene)indane-1,3-dione
- Molecular formula
- C16H10N2O2
- Molecular weight
- 262.26
Names & synonyms
2-(1,3-Dihydro-benzoimidazol-2-ylidene)-indan-1,3-dioneRefChem:450385654-057-763786-62-92-(1H-Benzo[d]imidazol-2(3H)-ylidene)-1H-indene-1,3(2H)-dione2-(1,3-dihydro-2H-benzimidazol-2-ylidene)-1H-indene-1,3(2H)-dione2-(1,3-Dihydro-2H-benzo[d]imidazol-2-ylidene)-1H-indene-1,3(2H)-dioneMFCD00170582NSC3662162-(3-HYDROBENZIMIDAZOL-2-YLIDENE)INDANE-1,3-DIONECambridge id 5156195Oprea1_041853
Show more names
1H-Indene-1,3(2H)-dione, 2-(1,3-dihydro-2H-benzimidazol-2-ylidene)-
Oprea1_404840CBDivE_003231SCHEMBL64802292-(1,3-dihydrobenzoimidazol-2-ylidene)indene-1,3-dioneDTXSID60419593HMS1674F20STL325647AKOS000522795
Database identifiers
- CAS
63786-62-9- PubChem CID
- 339482
- DTXSID
DTXSID60419593
Properties
Computed structural properties
- XLogP
- 2.5
- Topological polar surface area
- 66 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 459
Physicochemical properties
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 335 · H335-H315-H319
- Precautionary statements
- 264 · P264-P280-P305+P351+P338-P337+P313P-P264-P280-P302+P352-P321-P332+P313-P362
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
Warning
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (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. Each notification may be associated with multiple companies.
Hazard information
Hazard Classes and CategoriesSkin Irrit. 2 (100%)
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H335-H315-H319
- Precautionary statements
- P264-P280-P305+P351+P338-P337+P313P-P264-P280-P302+P352-P321-P332+P313-P362
Chemistry & industry
Suppliers4 total
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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