List 4593-90-2
New Version
CCD No. :
CCD00002645
CAS No. : 4593-90-2
Product Name : 3-PHENYLBUTYRIC ACID
MDL Number. : MFCD00002725
Formula : C10H12O2
MolWeight : 164.203
Synonyms :
3-PHENYLBUTYRIC ACID; OTAVA-BB 1042017; (+/-)-BETA-METHYLHYDROCINNAMIC ACID; 3-PHENYLBUTANOIC ACID; ATTERCOP-CHM AT127465; EMOLECULES 479201; ZYLEXA-PHARM ZP-TV000693; RARECHEM AL BE 0683; ZERENEX ZX-OA000693; (+/-)-3-PHENYLBUTYRIC ACID;
Mol : 3-PHENYLBUTYRIC A… .mol
CAS No. : 4593-90-2
Product Name : 3-PHENYLBUTYRIC ACID
MDL Number. : MFCD00002725
Formula : C10H12O2
MolWeight : 164.203
Synonyms :
3-PHENYLBUTYRIC ACID; OTAVA-BB 1042017; (+/-)-BETA-METHYLHYDROCINNAMIC ACID; 3-PHENYLBUTANOIC ACID; ATTERCOP-CHM AT127465; EMOLECULES 479201; ZYLEXA-PHARM ZP-TV000693; RARECHEM AL BE 0683; ZERENEX ZX-OA000693; (+/-)-3-PHENYLBUTYRIC ACID;
Mol : 3-PHENYLBUTYRIC A… .mol
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| Product Name： | 3-PHENYLBUTYRIC ACID |
| CAS： | 4593-90-2 |
| English Synonyms： | 3-PHENYLBUTYRIC ACID ; OTAVA-BB 1042017 ; (+/-)-BETA-METHYLHYDROCINNAMIC ACID ; 3-PHENYLBUTANOIC ACID ; ATTERCOP-CHM AT127465 ; EMOLECULES 479201 ; ZYLEXA-PHARM ZP-TV000693 ; RARECHEM AL BE 0683 ; ZERENEX ZX-OA000693 ; (+/-)-3-PHENYLBUTYRIC ACID |
| MDL Number.： | MFCD00002725 |
| H bond acceptor： | 2 |
| H bond donor： | 1 |
| Smile： | C1(=CC=CC=C1)C(CC(=O)O)C |
| InChi： | InChI=1S/C10H12O2/c1-8(7-10(11)12)9-5-3-2-4-6-9/h2-6,8H,7H2,1H3,(H,11,12) |
| InChiKey： | InChIKey=ZZEWMYILWXCRHZ-UHFFFAOYSA-N |
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| Melting Point： | 35-38 DEG C(LIT) |
| Boiling Point： | 170-172 DEG C/20 MMHG(LIT) |
| Density： | 1.515g/mLat25°C(lit.) |
| Physical Property： | FLASHPOINT: 110 DEG C FLASHPOINT: 230 DEG F |
| Comments： | OTHER NOTES: TANDEM MASS SPECTROMETRY DATA INDEPENDENTLY GENERATED BY SCRIPPS CENTER FOR METABOLOMICS IS AVAILABLE TO VIEW OR DOWNLOAD IN PDF. 116807.PDF TESTED METABOLITES ARE FEATURED ON SCRIPPS CENTER FOR METABOLOMICS METLIN METABOLITE DATABASE. TO LEARN MORE, VISIT SIGMA.COM/METLIN UNSPSC: 12352100 WGK: 3 |
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| WGK Germany： | 3 |
Basic Information
* If the product has intellectual property rights, a license granted is must or contact us.