Molecular Structure:
CCD No.:CCD00065699
XYLENOL ORANGE TETRASODIUM SALT
CAS No.:
3618-43-7
Formula:C31 H28 N2 O13 S . 4 Na
MolWeight:760.589
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| Product Name： | XYLENOL ORANGE TETRASODIUM SALT |
| CAS： | 3618-43-7 |
| English Synonyms： | XYLENOL ORANGE INDICATOR ( SODIUM SALT, WATER SOLUBLE) FOR METAL TITRATION ; XYLENOL ORANGE TETRASODIUM SALT ; 3,3'-BIS[N,N-BIS(CARBOXYMETHYL)AMINOMETHYL]-O-CRESOLSULFONEPHTHALEIN TETRASODIUM SALT |
| MDL Number.： | MFCD00135829 |
| H bond acceptor： | 15 |
| H bond donor： | 2 |
| Smile： | Cc1cc(cc(c1O)CN(CC(=O)[O-])CC(=O)[O-])/C(=C\2/C=C(C(=O)C(=C2)CN(CC(=O)[O-])CC(=O)[O-])C)/c3ccccc3S(=O)(=O)O.[Na+].[Na+].[Na+].[Na+] |
| InChi： | InChI=1S/C31H32N2O13S.4Na/c1-17-7-19(9-21(30(17)42)11-32(13-25(34)35)14-26(36)37)29(23-5-3-4-6-24(23)47(44,45)46)20-8-18(2)31(43)22(10-20)12-33(15-27(38)39)16-28(40)41;;;;/h3-10,42H,11-16H2,1-2H3,(H,34,35)(H,36,37)(H,38,39)(H,40,41)(H,44,45,46);;;;/q;4*+1/p-4/b29-20+;;;; |
| InChiKey： | InChIKey=RMRNOJGBXAZKHK-SIKJOQGZSA-J |
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| Melting Point： | 195 DEG C (DEC)(LIT)/210 oC |
| Comments： | GENERAL DESCRIPTION: VISIT OUR TITRATION CENTER TO LEARN MORE INDICATOR FOR METAL TITRATION SUITABILITY: PASSES TEST FOR SUITABILITY FOR COMPLEXOMETRY SUITABILITY: PASSES TEST FOR TEST OF SENSITIVITY UNSPSC: 12161500 WGK: 3 |
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| Safe Code： | S:S24/25; |
| WGK Germany： | 3 |
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