N,N-Dimethyl-4-(2-phenylethenyl)benzenamine
Basic information
- CAS
1145-73-9- Standard SMILES
CN(C)c1ccc(C=Cc2ccccc2)cc1- InChIKey
XGHHHPDRXLIMPM-UHFFFAOYSA-N- Molecular formula
- C16H17N
- Average molar mass
- 223.31 g/mol
- Monoisotopic mass
- 223.13609955
Names & identifiers
- Preferred name
- N,N-Dimethyl-4-(2-phenylethenyl)benzenamine
- IUPAC
- N,N-dimethyl-4-(2-phenylethenyl)aniline
- English name
- 4-(Dimethylamino)stilbene
- Molecular formula
- C16H17N
- Molecular weight
- 223.31
Names & synonyms
DTXSID20871810N,N-Dimethyl-4-(2-phenylethenyl)benzenamineRefChem:1090560DTXCID20819434N,N-Dimethyl-p-styrylanilineN,N-dimethyl-4-(2-phenylethenyl)anilineBenzenamine, N,N-dimethyl-4-(2-phenylethenyl)-4-DimethylaminostilbenStilbenyl-N,N-dimethylamineN,N-Dimethyl-4-aminostilbene4-Stilbenamine, N,N-dimethyl-4-Dimethylaminostilben [German]
Show more names
Dimethylaminostilbene4-(Dimethylamino)stibenep-(Dimethylamino)stilbene4-(Dimethylamino)stilbenePARA-DIMETHYLAMINOSTILBENEn,n-dimethyl-4-stilbenaminN,N-Dimethylstilben-4-amine
NSC 30991AI3-5250914301-11-2Maybridge3_002846N,N-Dimethyl-4-aminostilbenN,N-dimethyl-4-styryl-anilineSCHEMBL1557244Benzenamine,N,N-dimethyl-4-[(1Z)-2-phenylethenyl]- (9CI)
Database identifiers
- CAS
1145-73-9- PubChem CID
- 13284
- DTXSID
DTXSID20871810
Properties
Computed structural properties
- XLogP
- 4.6
- Topological polar surface area
- 3.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 3
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 230
Experimental & physicochemical properties
SpringerMaterials PropertiesAngular frequency
Physicochemical properties
- Melting point
- 149 °C · 149 °C
- Boiling point
- 354.61 °C · 354.61°C (rough estimate)
- Density
- 0.9415 · 0.9415 (rough estimate)
- refractive index
- 1.487 · 1.4870 (estimate)
- storage temp.
- Sealed in dry,Room Temperature
- solubility
- Chloroform (Slightly), Ethyl Acetate (Slightly)
- form
- Solid
- pka
- 4 · 4+-.0.12(Predicted)
- color
- Pale Beige to Light Yellow
- FDA UNII
- 1 V7P79915N · 1V7P79915N
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302+H312+H332
- Precautionary statements
- 261 · P261-P264-P270-P271-P280-P301+P312+P330-P302+P352+P312+P362+P364-P304+P340+P312-P501
- RTECS
- 3850000 · WJ3850000
- HS Code
- 2921.49 · 2921.49.5000
- Toxicity
- 50 · rat,LD50,intraperitoneal,70mg/kg (70mg/kg),Zeitschrift fuer Krebsforschung. Vol. 65, Pg. 272, 1963.
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- rtecs
- WJ3850000
- hs_code
- 2921.49.5000
- Toxicity
- rat,LD50,intraperitoneal,70mg/kg (70mg/kg),Zeitschrift fuer Krebsforschung. Vol. 65, Pg. 272, 1963.
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302+H312+H332
- Precautionary statements
- P261-P264-P270-P271-P280-P301+P312+P330-P302+P352+P312+P362+P364-P304+P340+P312-P501
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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