Basic information
- CAS
56750-80-2- Standard SMILES
Cc1ccc(C(=O)C=O)c(C)c1- InChIKey
LUNGAWJRQUYNRM-UHFFFAOYSA-N- Molecular formula
- C10H10O2
- Average molar mass
- 162.18 g/mol
- Monoisotopic mass
- 162.06807956
Names & identifiers
- Preferred name
- 2-(2,4-Dimethylphenyl)-2-oxoacetaldehyde
- IUPAC
- 2-(2,4-dimethylphenyl)-2-oxoacetaldehyde
- English name
- 2-(2,4-Dimethylphenyl)-2-oxoacetaldehyde
- Molecular formula
- C10H10O2
- Molecular weight
- 162.19
Names & synonyms
2-(2,4-dimethylphenyl)-2-oxoacetaldehyde56750-80-2(2,4-dimethylphenyl)(oxo)acetaldehydeNSC-1563002,4-dimethylphenylglyoxalNSC1563003VZ5M74BNXSCHEMBL8102200DTXSID50972203STK6715142-(2,4-dimethylphenyl)-2-oxoethanalAKOS005592548
Show more names
Benzeneacetaldehyde, 2,4-dimethyl-α-oxo-
2,4-Dimethyl-alpha-oxobenzeneacetaldehydeST40200812-(2,4-dimethylphenyl)-2-oxo-acetaldehydeCS-0331755Benzeneacetaldehyde, 2,4-dimethyl-alpha-oxo-F0904-7466
Database identifiers
- CAS
56750-80-2- PubChem CID
- 291297
- DTXSID
DTXSID50972203- UNII
- 3VZ5M74BNX
- Nikkaji
- J3.600.215H
Properties
Computed structural properties
- XLogP
- 2
- Topological polar surface area
- 34.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 186
Physicochemical properties
- Boiling point
- 118 · 118-123 °C
- Density
- 1.075 · 1.075±0.06 g/cm3(Predicted)
Chemistry & industry
Suppliers6 total
北京福源坊科技有限公司010-57903446 15869909019 · [email protected]
苏州市森菲达化工有限公司18796480002 18796480002 · [email protected]
无锡丽恒昇生物医药科技有限公司15250805028 15250805028 · [email protected]
山东李比希生物医药科技有限公司15318973357; 15318973357 · [email protected]
北京福源坊科技有限公司010-57903446 15869909019 · [email protected]
南兴化工（江苏）有限公司0512-66387035 18662433356 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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