4-ETHYLBENZOIC ACID ,619-64-7 _Chemical Cloud Database

4-ETHYLBENZOIC ACID

Basic Information
Product Name：	4-ETHYLBENZOIC ACID
CAS：	619-64-7
English Synonyms：	ZERENEX ZX-OA005071 ; EMOLECULES 486781 ; ZYLEXA-PHARM ZP-TV005071 ; 4-ETHYLBENZOIC ACID ; BENZOIC ACID, 4-ETHYL- ; OTAVA-BB 7018912388 ; RARECHEM AL BO 1281 ; P-ETHYLBENZOIC ACID
MDL Number.：	MFCD00002570
H bond acceptor：	2
H bond donor：	1
Smile：	C(C)C1=CC=C(C(=O)O)C=C1
InChi：	InChI=1S/C9H10O2/c1-2-7-3-5-8(6-4-7)9(10)11/h3-6H,2H2,1H3,(H,10,11)
InChiKey：	InChIKey=ZQVKTHRQIXSMGY-UHFFFAOYSA-N
Property
Melting Point：	112-113 DEG C(LIT)
Comments：	OTHER NOTES: TANDEM MASS SPECTROMETRY DATA INDEPENDENTLY GENERATED BY SCRIPPS CENTER FOR METABOLOMICS IS AVAILABLE TO VIEW OR DOWNLOAD IN PDF. 191280.PDF TESTED METABOLITES ARE FEATURED ON SCRIPPS CENTER FOR METABOLOMICS METLIN METABOLITE DATABASE. TO LEARN MORE, VISIT SIGMA.COM/METLIN UNSPSC: 12352100 WGK: 3
Safety information
WGK Germany：	3

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