3,5,5-Trimethylhexanoyl chloride
- Product Name3,5,5-Trimethylhexanoyl chloride
- CAS36727-29-4
- CBNumberCB4278902
- MFC9H17ClO
- MW176.68
- EINECS253-168-4
- MDL NumberMFCD00044028
- MOL File36727-29-4.mol
- MSDS FileSDS
Chemical Properties
| Boiling point | 188-190 °C (lit.) |
| Density | 0.93 g/mL at 25 °C (lit.) |
| refractive index | n |
| Flash point | 284 °F |
| form | clear liquid |
| color | Colorless to Light yellow |
| Specific Gravity | 0.940 |
| InChI | InChI=1S/C9H17ClO/c1-7(5-8(10)11)6-9(2,3)4/h7H,5-6H2,1-4H3 |
| InChIKey | GEKPNPPFAYJZRD-UHFFFAOYSA-N |
| SMILES | C(Cl)(=O)CC(C)CC(C)(C)C |
| CAS DataBase Reference | 36727-29-4(CAS DataBase Reference) |
| EWG's Food Scores | 1 |
| FDA UNII | Z2J193VP5M |
| EPA Substance Registry System | Hexanoyl chloride, 3,5,5-trimethyl- (36727-29-4) |
| UNSPSC Code | 12352100 |
| NACRES | NA.22 |
Safety
| Symbol(GHS) |
 
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| Signal word | Danger | |||||||||
| Hazard statements | H290-H302-H314-H317-H330-H412 | |||||||||
| Precautionary statements | P273-P280-P301+P312-P303+P361+P353-P304+P340+P310-P305+P351+P338 | |||||||||
| Hazard Codes | C,T+ | |||||||||
| Risk Statements | 14-20-34-52/53-43-35-26-22 | |||||||||
| Safety Statements | 26-27-36/37/39-45-61 | |||||||||
| RIDADR | 3389 | |||||||||
| WGK Germany | 1 | |||||||||
| RTECS | MP4560000 | |||||||||
| TSCA | TSCA listed | |||||||||
| HS Code | 2915.90.5010 | |||||||||
| HazardClass | 8 | |||||||||
| PackingGroup | III | |||||||||
| Storage Class | 6.1A - Combustible acute toxic Cat. 1 and 2 very toxic hazardous materials | |||||||||
| Hazard Classifications | Acute Tox. 1 Inhalation Acute Tox. 4 Oral Aquatic Chronic 3 Met. Corr. 1 Skin Corr. 1A Skin Sens. 1 | |||||||||
| Toxicity | rat,LC50,inhalation,240ppm/4H (240ppm),SKIN AND APPENDAGES (SKIN): HAIR: OTHERGASTROINTESTINAL: CHANGES IN STRUCTURE OR FUNCTION OF SALIVARY GLANDSBEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY),National Technical Information Service. Vol. OTS0539748, | |||||||||
| NFPA 704: |
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