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Isononanoyl chloride · CAS 36727-29-4 · C9H17ClO. UNII Z2J193VP5M.
| CAS Registry Number | 36727-29-4 |
|---|---|
| PubChem CID | 161929 |
| Molecular formula | C9H17ClO |
| IUPAC name | 3,5,5-trimethylhexanoyl chloride |
| UNII (FDA) | Z2J193VP5M |
| Molecular Weight | 176.68 |
|---|---|
| XLogP3 | 3.8 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 1 |
| Rotatable Bond Count | 4 |
| Exact Mass | 176.0967929 |
| Monoisotopic Mass | 176.0967929 |
| Topological Polar Surface Area | 17.1 |
| Heavy Atom Count | 11 |
| Formal Charge | 0 |
| Reported hazard statements | H290 (98.7%), H302 (98.7%), H314 (99.3%), H317 (30.1%), H318 (69.9%), H330 (98.7%), H412 (98%) |
|---|
H290 (98.7%): May be corrosive to metals [Warning Corrosive to Metals]
H302 (98.7%): Harmful if swallowed [Warning Acute toxicity, oral]
3,5,5-Trimethylhexanoyl chloride; Isononanoic acid chloride; Hexanoyl chloride, 3,5,5-trimethyl-; DTXSID0049284; EINECS 253-168-4; UNII-Z2J193VP5M; Z2J193VP5M; DTXCID9029140; EC 253-168-4; Hexanoylchloride,3,5,5-trimethyl-; 3,5,5-trimethylhexanoic acid chloride; 2,4,4-TRIMETHYLHEXANOYL CHLORIDE; RefChem:91309; 253-168-4; GEKPNPPFAYJZRD-UHFFFAOYSA-N; 36727-29-4
CAS 36727-29-4; molecular formula C9H17ClO; molecular weight — g/mol.
3,5,5-Trimethylhexanoyl chloride, Isononanoic acid chloride, Hexanoyl chloride, 3,5,5-trimethyl-, DTXSID0049284, EINECS 253-168-4, UNII-Z2J193VP5M.
Hazard statements reported: H290, H302, H314, H317, H318.
Facts on this page are taken from PubChem (US National Library of Medicine) and Wikidata. Grade-specific data — assay, moisture, particle size, packaging, shelf life — is issued per batch on the COA and is not published here.