Benzeneacetaldehyde, 2-methyl-
Basic information
- CAS
10166-08-2- Standard SMILES
Cc1ccccc1CC=O- InChIKey
ACHWKVVBZRANAV-UHFFFAOYSA-N- Molecular formula
- C9H10O
- Average molar mass
- 134.17 g/mol
- Monoisotopic mass
- 134.07316494
Names & identifiers
- Preferred name
- Benzeneacetaldehyde, 2-methyl-
- IUPAC
- 2-(2-methylphenyl)acetaldehyde
- English name
- Benzeneacetaldehyde, 2-methyl- (9CI)
- Molecular formula
- C9H10O
- Molecular weight
- 134.18
Names & synonyms
10166-08-22-(2-methylphenyl)acetaldehydeBenzeneacetaldehyde, 2-methyl-m-MethylphenylacetaldehydeDTXSID8064981RefChem:562804DTXCID6032649631-324-6(2-Methylphenyl)acetaldehyde2-(2-Methylphenyl)ethanal2-(o-Tolyl)acetaldehyde2-Methylbenzeneethanal
Show more names
2-TOLYLACETALDEHYDE2-Methylbenzeneacetaldehyde2-（2-methylphenyl）ethylaldehyde2-(2-methylphenyl)acetaldehyde（WS200521）
MFCD02261772Benzeneacetaldehyde, 2-methyl- (9CI)Benzeneacetaldehyde,2-methyl-O-Tolyl-Acetaldehyde2-O-TOLYLACETALDEHYDE69380-02-5o-TolylacetaldehydSCHEMBL168282
Database identifiers
- CAS
10166-08-2、69380-02-5- PubChem CID
- 66286
- DTXSID
DTXSID8064981- EC Number
- 631-324-6
- Nikkaji
- J414.434A
Properties
Computed structural properties
- XLogP
- 1.9
- Topological polar surface area
- 17.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 2
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 109
Physicochemical properties
- Boiling point
- 221 °C · 221°C (estimate)
- Density
- 1.0241 · 1.0241
- refractive index
- 1.5255 · 1.5255 (estimate)
- EPA Substance Registry System
- 2 · Benzeneacetaldehyde, 2-methyl- (10166-08-2)
- Symbol(GHS)
- 7 · GHS07,GHS05
- Signal word
- Danger
- Hazard statements
- 318 · H318-H302
- Precautionary statements
- 280 · P280-P305+P351+P338-P310-P264-P270-P301+P312-P330-P501
- TSCA
- TSCA listed
- HS Code
- 2912299000 · 2912299000
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
Danger
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P264, P264+P265, P270, P280, P301+P317, P305+P354+P338, P317, P330, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 39 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Regulatory InformationChemical: Benzeneacetaldehyde, 2-methyl-
Other Safety InformationEvaluation - Chemicals not considered for in depth evaluation - Not commercially active in Australia
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Safety data
- tsca
- TSCA listed
- hs_code
- 2912299000
- Signal word
- Danger
- Symbol(GHS)
- GHS07,GHS05
- Hazard statements
- H318-H302
- Precautionary statements
- P280-P305+P351+P338-P310-P264-P270-P301+P312-P330-P501
Chemistry & industry
Uses & manufacturing
General Manufacturing InformationBenzeneacetaldehyde, 2-methyl-: INACTIVE
Upstream & downstream products
Downstream products
Related reactions
3 records
Compound notes
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