(+/-)-3-苯基丁酸

pro_cas
4593-90-2
pro_cdbregno
CCD00002645
pro_formula
C10H12O2
pro_molWeight
164.203

basic_info

Product_Name: (+/-)-3-苯基丁酸
CAS: 4593-90-2
中文同义词: 3-苯基丁酸 ; (+/-)-3-苯基丁酸
EnglishSynonyms: ATTERCOP-CHM AT127465 ; (+/-)-3-PHENYLBUTYRIC ACID ; ZYLEXA-PHARM ZP-TV000693 ; RARECHEM AL BE 0683 ; OTAVA-BB 1042017 ; 3-PHENYLBUTANOIC ACID ; 3-PHENYLBUTYRIC ACID ; EMOLECULES 479201 ; (+/-)-BETA-METHYLHYDROCINNAMIC ACID ; ZERENEX ZX-OA000693
pro_mdlNumber: MFCD00002725
pro_acceptors: 2
pro_donors: 1
pro_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

property

MeltingPoint: 35-38 DEG C(LIT)
Boiling_Point: 170-172 DEG C/20 MMHG(LIT)
Density: 1.515g/mLat25°C(lit.)
PhysicalProperty: 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

secure_info

secure_wgk_germany: 3

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