4-(Dichloromethyl)-2,3,5,6-tetramethylbenzaldehyde
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Basic information
- CAS
148990-19-6- Standard SMILES
Cc1c(C)c(C(Cl)Cl)c(C)c(C)c1C=O- InChIKey
IBYGLWWBFPWRRH-UHFFFAOYSA-N- Molecular formula
- C12H14Cl2O
- Average molar mass
- 245.14 g/mol
- Monoisotopic mass
- 244.0421705
Names & identifiers
- Preferred name
- 4-(Dichloromethyl)-2,3,5,6-tetramethylbenzaldehyde
- IUPAC
- 4-(dichloromethyl)-2,3,5,6-tetramethylbenzaldehyde
- English name
- benzaldehyde, 4-(dichloromethyl)-2,3,5,6-tetramethyl-
- Molecular formula
- C12H14Cl2O
- Molecular weight
- 245.15
Names & synonyms
4-(dichloromethyl)-2,3,5,6-tetramethylbenzaldehyde148990-19-6MFCD00447911Benzaldehyde, 4-(dichloromethyl)-2,3,5,6-tetramethyl-ALBB-013668STK897901AKOS003243914LS-04294ST020052H304534-(dichloromethyl)-2,3,5,6-tetramethyl-benzaldehydeZINC00042570
Database identifiers
- CAS
148990-19-6- PubChem CID
- 678546
- EC Number
- 163-760-3
Properties
Computed structural propertiesFilling in
- XLogP
- 4
- Topological polar surface area
- 17.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 2
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 214
Physicochemical properties
- Boiling point
- 366.1 · 366.1±37.0 °C(Predicted)
- Density
- 1.189 · 1.189±0.06 g/cm3(Predicted)
- HazardClass
- IRRITANT
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, P271, P280, P302+P352, P304+P340, P319, P321, P332+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesSkin Irrit. 2 (100%)
Safety data
- hazard_class
- IRRITANT
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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