Basic information
- CAS
98-04-4- Standard SMILES
C[N+](C)(C)c1ccccc1.[I-]- InChIKey
KKLAORVGAKUOPZ-UHFFFAOYSA-M- Molecular formula
- C9H14IN
- Average molar mass
- 263.12 g/mol
- Monoisotopic mass
- 263.0171
Names & identifiers
- Preferred name
- Trimethyl(phenyl)azanium iodide
- IUPAC
- trimethyl(phenyl)azanium iodide
- English name
- Phenyltrimethylammonium iodide
- Molecular formula
- C9H14IN
- Molecular weight
- 263.12
Names & synonyms
trimethylanilliniumiodideTriMethylaniliniuM Iodidephenyltrimethyl-ammoniuiodiden,n-dimethylanilinemethiodidetrimethylphenyl-ammoniuiodideTrimethylphenylaminium iodideTriMethylphenylaMMoniuM IodidTRIMETHYLPHENYLAMMONIUM IODIDEPHENYLTRIMETHYLAMMONIUM IODIDEn,n,n-trimethylaniliniumiodide
Database identifiers
- CAS
98-04-4- PubChem CID
- 577690
- Nikkaji
- J3.100.442J
Properties
Computed structural properties
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 0
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 101
Physicochemical properties
- Melting point
- 227 °C · 227 °C (subl.)(lit.)
- Boiling point
- 212 °C · 212 °C
- Density
- 1.4709 · 1.4709 (estimate)
- storage temp.
- Refrigerator
- solubility
- Methanol, Water
- form
- Slightly Crystalline Powder or Flakes
- color
- White to slightly green
- Water Solubility
- Soluble in water and methanol.
- Sensitive
- Light Sensitive
- Merck
- 14 · 14,7318
- BRN
- 3916752 · 3916752
- CAS DataBase Reference
- 98 · 98-04-4(CAS DataBase Reference)
- FDA UNII
- 4 O888XQ7FP · 4O888XQ7FP
- EPA Substance Registry System
- Phenyltrimethylammonium iodide (98-04-4)
- Symbol(GHS)
- 6 · GHS06,GHS07
- Signal word
- Danger
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
- F
- 3-8
- wgk
- 3
- tsca
- TSCA listed
- rtecs
- BT2450000
- ridadr
- UN2811
- hs_code
- 29239000
- risk_code
- 36/37/38-41
- Signal word
- Danger
- Symbol(GHS)
- GHS06,GHS07
- hazard_code
- Xi
- safety_code
- 26-36/39-37/39
- hazard_class
- 6.1
- packing_group
- III
- Hazard statements
- H301+H311+H331-H315-H319-H302-H311-H335
- Precautionary statements
- P304+P340-P305+P351+P338-P501a-P261-P264-P270-P271-P280-P301+P310+P330-P302+P352+P312+P361+P364-P304+P340+P311-P305+P351+P338+P337+P313-P403+P233-P405-P501
Chemistry & industry
Applications
UsesPhenyltrimethylammonium iodide is an important raw material and intermediate used in organic synthesis, pharmaceuticals, dyes and agrochemicals.
UsesFor the detection and determination of cadmium.
Upstream & downstream products
Downstream products
Suppliers60 total
梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
阿诺西（上海）生物技术有限公司400-1107768 15058188853 · [email protected]
湖北永阔科技有限公司027-59223108 15972152991 · [email protected]
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
湖南韵邦生物科技股份有限公司0731-88532326 13319508186 · [email protected]
Hebei Chuanghai Biotechnology Co., Ltd+86-17732866630 · [email protected]
上海毕得医药科技股份有限公司400-1647117 13681763483 · [email protected]
河北创海生物科技有限公司+86-86-13131129325 · [email protected]
安徽合诺生物科技有限公司
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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