Basic Information |
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Product Name: | N-(4-NITROBENZOYL)-L-GLUTAMIC ACID HEMIHYDRATE |
CAS: | 6758-40-3 |
English Synonyms: | L-GLUTAMIC ACID,N-(4-NITROBENZOYL)- ; N-(4-NITROBENZOYL)-L-GLUTAMIC ACID HEMIHYDRATE |
MDL Number.: | MFCD00149508 |
H bond acceptor: | 9 |
H bond donor: | 3 |
Smile: | c1cc(ccc1C(=O)N[C@@H](CCC(=O)O)C(=O)O)[N+](=O)[O-].O |
InChi: | InChI=1S/C12H12N2O7.H2O/c15-10(16)6-5-9(12(18)19)13-11(17)7-1-3-8(4-2-7)14(20)21;/h1-4,9H,5-6H2,(H,13,17)(H,15,16)(H,18,19);1H2/t9-;/m0./s1 |
InChiKey: | InChIKey=WJISEKQTKJGQCR-FVGYRXGTSA-N |
Property |
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Melting Point: | 111-118 DEG C |
Comments: | EINECS: 229-820-9 HAZARD: S24/25 OPTICAL ROTATION: +15 DEG, C=2,0.1N NAOH TSCA: N |
Safety information |
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