Benzenemethanaminium, 4-benzoyl-N,N,N-trimethyl-, chloride (1:1)
Basic information
- CAS
78697-25-3- Standard SMILES
C[N+](C)(C)Cc1ccc(C(=O)c2ccccc2)cc1.[Cl-]- InChIKey
UROHSXQUJQQUOO-UHFFFAOYSA-M- Molecular formula
- C17H20ClNO
- Average molar mass
- 289.8 g/mol
- Monoisotopic mass
- 289.123342
Names & identifiers
- Preferred name
- Benzenemethanaminium, 4-benzoyl-N,N,N-trimethyl-, chloride (1:1)
- IUPAC
- (4-benzoylphenyl)methyl-trimethylazanium chloride
- English name
- (4-Benzoylbenzyl)trimethylammonium chloride, 95
- Molecular formula
- C17H20ClNO
- Molecular weight
- 289.8
Names & synonyms
78697-25-3Benzenemethanaminium, 4-benzoyl-N,N,N-trimethyl-, chlorideEINECS 278-972-2DTXSID90888551Benzenemethanaminium, 4-benzoyl-N,N,N-trimethyl-, chloride (1:1)RefChem:117608DTXCID301027828(p-Benzoylbenzyl)trimethylammonium chloride(4-BENZOYLBENZYL)TRIMETHYLAMMONIUM CHLORIDE(4-benzoylphenyl)methyl-trimethylazanium;chloride(4-BENZOYLBENZYL)TRIMETHYLAMMONIUM CHLORIDE, 95SCHEMBL51184
Show more names
4-Benzoylbenzyltrimethylaminium·chloride(4-Benzoylbenzyl)trimethylaminium·chloride(4-benzoylphenyl)methyl-trimethylazanium chloride4-benzoyl-n,n,n-trimethyl-benzenemethanaminiuchloride1-(4-Benzoylphenyl)-N,N,N-trimethylmethanaminium (chloride)
UROHSXQUJQQUOO-UHFFFAOYSA-MAKOS024364952NS00091108ST50997499G92149F576186(4-benzoylphenyl)methyl-trimethyl-ammonium;chloride4-benzoyl-n,n,n-trimethylbenzenemethanaminium chloride
Database identifiers
- CAS
78697-25-3- PubChem CID
- 174155
- DTXSID
DTXSID90888551- EC Number
- 278-972-2
Properties
Computed structural properties
- Topological polar surface area
- 17.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 4
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 291
Physicochemical properties
- Melting point
- 205 °C · 205 °C (dec.)(lit.)
- EPA Substance Registry System
- 4 · Benzenemethanaminium, 4-benzoyl-N,N,N-trimethyl-, chloride (78697-25-3)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 280 · P280-P305+P351+P338
- Hazard Codes
- Xi
- Risk Statements
- 36 · 36/37/38
- Safety Statements
- 26 · 26-36
- TSCA
- TSCA listed
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Hazard information
Regulatory InformationPMN - indicates a commenced PMN (Pre-Manufacture Notices) substance.
Safety data
- tsca
- TSCA listed
- risk_code
- 36/37/38
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- Xi
- safety_code
- 26-36
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P280-P305+P351+P338
Chemistry & industry
Uses & manufacturing
General Manufacturing InformationBenzenemethanaminium, 4-benzoyl-N,N,N-trimethyl-, chloride (1:1): INACTIVE
Suppliers
Loading…
Open inquiries
Loading…
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…