Molecular Structure:
CAS No.:
97-06-3
;51591-66-3
Product Name.:
CCD No.:CCD00023188
Formula:C7 H7 N O5 S
MolWeight:217.2
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| Product Name： | 2-NITROTOLUENE-4-SULFONIC ACID |
| CAS： | 97-06-3 ;51591-66-3 |
| English Synonyms： | 1-METHYL-2-NITROBENZENE-4-SULFONIC ACID ; ABLOCK AB-12-9778 ; 4-METHYL-3-NITROBENZENSULFONIC ACID ; 3-NITRO-4-METHYLBENZENESULFONIC ACID ; 2-NITROTOLUENE-4-SULFONIC ACID ; 4-METHYL-3-NITROBENZENE-1-SULFONIC ACID |
| MDL Number.： | MFCD00035917 |
| H bond acceptor： | 6 |
| H bond donor： | 1 |
| Smile： | Cc1ccc(cc1[N+](=O)[O-])S(=O)(=O)O |
| InChi： | InChI=1S/C7H7NO5S/c1-5-2-3-6(14(11,12)13)4-7(5)8(9)10/h2-4H,1H3,(H,11,12,13) |
| InChiKey： | InChIKey=GJYYWZTYFNSZRP-UHFFFAOYSA-N |
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Basic Information
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