Molecular Structure:
CCD No.:CCD00029583
3-METHYLHIPPURIC ACID
CAS No.:
27115-49-7
Formula:C10 H11 N O3
MolWeight:193.201
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| Product Name： | 3-METHYLHIPPURIC ACID |
| CAS： | 27115-49-7 |
| English Synonyms： | GLYCINE,N-(3-METHYLBENZOYL)- ; ZERENEX E/1009360 ; [(3-METHYLBENZOYL)AMINO]ACETIC ACID ; N-(3-METHYLBENZOYL)GLYCINE ; 2-[(3-METHYLPHENYL)CARBONYLAMINO]ACETIC ACID ; 2-[(3-METHYLPHENYL)FORMAMIDO]ACETIC ACID ; M-TOLURIC ACID ; N-(M-TOLUOYL)GLYCINE ; M-METHYLHIPPURIC ACID ; 3-METHYLHIPPURIC ACID ; 2-[(3-METHYLBENZOYL)AMINO]ACETIC ACID |
| MDL Number.： | MFCD00044399 |
| H bond acceptor： | 4 |
| H bond donor： | 2 |
| Smile： | Cc1cccc(c1)C(=O)NCC(=O)O |
| InChi： | InChI=1S/C10H11NO3/c1-7-3-2-4-8(5-7)10(14)11-6-9(12)13/h2-5H,6H2,1H3,(H,11,14)(H,12,13) |
| InChiKey： | InChIKey=YKAKNMHEIJUKEX-UHFFFAOYSA-N |
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| Melting Point： | 138-140 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. 328014.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
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