| Name： | 3-METHYL-4-PENTENOIC ACID |
| CAS： | 1879-03-4 |
| Synonyms： | 3-METHYL-4-PENTENOIC ACID ; 3-METHYLPENT-4-ENOIC ACID |
| MDL.： | MFCD03427129 |
| H bond acceptor： | 2 |
| H bond donor： | 1 |
| Smile： | CC(CC(=O)O)C=C |
| InChi： | InChI=1S/C6H10O2/c1-3-5(2)4-6(7)8/h3,5H,1,4H2,2H3,(H,7,8) |
| InChiKey： | InChIKey=QNPZXLANENFTFK-UHFFFAOYSA-N |
Property |
|
| Boiling Point： | 75-76 DEG C/4 MMHG(LIT) |
| Density： | 0.94g/mLat25°C(lit.) |
| Physical Property： | FLASHPOINT: 199.4 DEG F FLASHPOINT: 93 DEG C REFRACTIVE INDEX: N20/D 1.429(LIT) |
| Comments： | OTHER NOTES: TANDEM MASS SPECTROMETRY DATA INDEPENDENTLY GENERATED BY SCRIPPS CENTER FOR METABOLOMICS IS AVAILABLE TO VIEW OR DOWNLOAD IN PDF. 553115.PDF TESTED METABOLITES ARE FEATURED ON SCRIPPS CENTER FOR METABOLOMICS METLIN METABOLITE DATABASE. TO LEARN MORE, VISIT SIGMA.COM/METLIN RIDADR: UN 3265 8/PG 2 UNSPSC: 12352100 WGK: 3 |
Safety information |
|
| Symbol： |
GHS05
|
| Signal word： | Danger |
| Hazard statements： | H314 |
| Precautionary statements： | P280-P305 + P351 + P338-P310 |
| hazard symbol： | C |
| Risk Code： | R:34 |
| Safe Code： | S:23-26-36/37/39-45 |
| WGK Germany： | 3 |
3-METHYL-4-PENTENOIC ACID
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