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3-HYDROXY-4-METHOXYPHENYLACETIC ACID

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Name: 3-HYDROXY-4-METHOXYPHENYLACETIC ACID
CAS: 1131-94-8
Synonyms: BENZENEACETIC ACID, 3-HYDROXY-4-METHOXY- ; HOMOISOVANILLIC ACID ; 3-HYDROXY-4-METHOXYPHENYLACETIC ACID ; 2-(3-HYDROXY-4-METHOXYPHENYL)ACETIC ACID
MDL.: MFCD00016829
H bond acceptor: 4
H bond donor: 2
Smile: COc1ccc(cc1O)CC(=O)O
InChi: InChI=1S/C9H10O4/c1-13-8-3-2-6(4-7(8)10)5-9(11)12/h2-4,10H,5H2,1H3,(H,11,12)
InChiKey: InChIKey=BWXLCOBSWMQCGP-UHFFFAOYSA-N

Property

Melting Point: 127-132 DEG C/127-132 °C
Comments: OTHER NOTES: TANDEM MASS SPECTROMETRY DATA INDEPENDENTLY GENERATED BY SCRIPPS CENTER FOR METABOLOMICS IS AVAILABLE TO VIEW OR DOWNLOAD IN PDF. 716391.PDF TESTED METABOLITES ARE FEATURED ON SCRIPPS CENTER FOR METABOLOMICS METLIN METABOLITE DATABASE. TO LEARN MORE, VISIT SIGMA.COM/METLIN
WGK: 3

Safety information

Symbol: GHS07 GHS07
Signal word: Warning
Hazard statements: H302-H315-H319-H335
Precautionary statements: P261-P305 + P351 + P338
hazard symbol: Xn
Risk Code: R:22-36/37/38
Safe Code: S:26-36
WGK Germany: 3

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