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3-sulfobenzoic acids

Description:

Sulfobenzoic acid carrying the sulfonyl group at the 3-position of the benzene group.

Ancestors:

Organic compounds ⮕ Benzenoids ⮕ Benzene and substituted derivatives ⮕ Benzenesulfonic acids and derivatives ⮕ Sulfobenzoic acids ⮕ 3-sulfobenzoic acids
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Items 1-12 of 13

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  1. 5-Sulfosalicylic acid dihydrate
    Cas Number: 5965-83-3        EC Number: 202-555-6        Compound CID:  2723734
    Formula:  C7H6O6S·2H2O        Molecular Weight: 254.21
    IUPAC Name:  2-hydroxy-5-sulfobenzoic acid;dihydrate
    SMILES:  C1=CC(=C(C=C1S(=O)(=O)O)C(=O)O)O.O.O
    InChIKey: BHDKTFQBRFWJKR-UHFFFAOYSA-N
    InChI:  InChI=1S/C7H6O6S.2H2O/c8-6-2-1-4(14(11,12)13)3-5(6)7(9)10;;/h1-3,8H,(H,9,10)(H,11,12,13);2*1H2
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  2. 5-Sulfoanthranilic Acid
      Grade & Purity: 
    • ≥98%(HPLC)
    • H2O≤10%
    Cas Number: 3577-63-7        Compound CID:  19151
    Formula:  C7H7NO5S        Molecular Weight: 217.2
    IUPAC Name:  2-amino-5-sulfobenzoic acid
    SMILES:  C1=CC(=C(C=C1S(=O)(=O)O)C(=O)O)N
    InChIKey: MJNYPLCGWXFYPD-UHFFFAOYSA-N
    InChI:  InChI=1S/C7H7NO5S/c8-6-2-1-4(14(11,12)13)3-5(6)7(9)10/h1-3H,8H2,(H,9,10)(H,11,12,13)
    Synonyms: 2-Amino-5-sulfobenzoic acid
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  3. 5-Sulfosalicylic acid
      Grade & Purity: 
    • ≥98%
    Cas Number: 97-05-2        Compound CID:  7322
    Formula:  C7H6O6S        Molecular Weight: 218.19
    IUPAC Name:  2-hydroxy-5-sulfobenzoic acid
    SMILES:  C1=CC(=C(C=C1S(=O)(=O)O)C(=O)O)O
    InChIKey: YCPXWRQRBFJBPZ-UHFFFAOYSA-N
    InChI:  InChI=1S/C7H6O6S/c8-6-2-1-4(14(11,12)13)3-5(6)7(9)10/h1-3,8H,(H,9,10)(H,11,12,13)
    Synonyms: 2-Hydroxy-5-sulfobenzoic acid
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  4. 5-Sulfoisophthalicacid
      Grade & Purity: 
    • ≥95%
    Cas Number: 22326-31-4
    Formula:  C8H6O7S        Molecular Weight: 246.19
    IUPAC Name:  5-sulfobenzene-1,3-dicarboxylic acid
    SMILES:  C1=C(C=C(C=C1C(=O)O)S(=O)(=O)O)C(=O)O
    InChIKey: CARJPEPCULYFFP-UHFFFAOYSA-N
    InChI:  InChI=1S/C8H6O7S/c9-7(10)4-1-5(8(11)12)3-6(2-4)16(13,14)15/h1-3H,(H,9,10)(H,11,12)(H,13,14,15)
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  5. 5-Sulfosalicylic acid hydrate
      Grade & Purity: 
    • ≥95%
    Cas Number: 304851-84-1        Compound CID:  665025
    Formula:  HO3SC6H3-2-(OH)CO2H·xH2O        Molecular Weight: 218.18 (anhydrous basis)
    IUPAC Name:  2-hydroxy-5-sulfobenzoic acid;hydrate
    SMILES:  C1=CC(=C(C=C1S(=O)(=O)O)C(=O)O)O.O
    InChIKey: PAUDQWJTTVPGHZ-UHFFFAOYSA-N
    InChI:  InChI=1S/C7H6O6S.H2O/c8-6-2-1-4(14(11,12)13)3-5(6)7(9)10;/h1-3,8H,(H,9,10)(H,11,12,13);1H2
    Synonyms: J-017979 | 5-Sulfosalicylic acid hydrate | AS-67604 | SMR000046135 | 5-SULFOSALICYLIC ACID HYDRATE 95 | MLS000084589...
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  6. 2-Sulfoterephthalic Acid Monosodium Salt
      Grade & Purity: 
    • ≥98%(HPLC)
    Cas Number: 19089-60-2
    Formula:  C8H5NaO7S        Molecular Weight: 268.17
    IUPAC Name:  sodium;4-carboxy-2-sulfobenzoate
    SMILES:  C1=CC(=C(C=C1C(=O)O)S(=O)(=O)O)C(=O)[O-].[Na+]
    InChIKey: JARIJYUQOKFVAJ-UHFFFAOYSA-M
    InChI:  InChI=1S/C8H6O7S.Na/c9-7(10)4-1-2-5(8(11)12)6(3-4)16(13,14)15;/h1-3H,(H,9,10)(H,11,12)(H,13,14,15);/q;+1/p-1
    Synonyms: AKOS027320127 | SCHEMBL17631898 | 1,4-Benzenedicarboxylic acid, 2-sulfo-, monosodium salt | 1,4-Benzenedicarboxylic a...
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  7. 5-Sulfosalicylic acid dihydrate
      Grade & Purity: 
    • CP
      •
    • ≥98%
    Cas Number: 5965-83-3        EC Number: 202-555-6        Compound CID:  2723734
    Formula:  C7H6O6S·2H2O        Molecular Weight: 254.21
    IUPAC Name:  2-hydroxy-5-sulfobenzoic acid;dihydrate
    SMILES:  C1=CC(=C(C=C1S(=O)(=O)O)C(=O)O)O.O.O
    InChIKey: BHDKTFQBRFWJKR-UHFFFAOYSA-N
    InChI:  InChI=1S/C7H6O6S.2H2O/c8-6-2-1-4(14(11,12)13)3-5(6)7(9)10;;/h1-3,8H,(H,9,10)(H,11,12,13);2*1H2
    Synonyms: SULFOSALICYLIC ACID DIHYDRATE [MI] | Salicylic acid, 5-sulfo-, dihydrate | 2-Hydroxy-5-sulfobenzoic-acid | Salicylic ...
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  8. 5-Sulfoisophthalic acid sodium salt
      Grade & Purity: 
    • ≥98%
    Cas Number: 6362-79-4        EC Number: 228-845-2        Compound CID:  23670844
    Formula:  C8H5NaO7S        Molecular Weight: 268.18
    IUPAC Name:  sodium;3,5-dicarboxybenzenesulfonate
    SMILES:  C1=C(C=C(C=C1C(=O)O)S(=O)(=O)[O-])C(=O)O.[Na+]
    InChIKey: YXTFRJVQOWZDPP-UHFFFAOYSA-M
    InChI:  InChI=1S/C8H6O7S.Na/c9-7(10)4-1-5(8(11)12)3-6(2-4)16(13,14)15;/h1-3H,(H,9,10)(H,11,12)(H,13,14,15);/q;+1/p-1
    Synonyms: AKOS015963289 | Benzene-1,3-dicarboxylic acid, 5-sulfo-, monosodium salt | A868087 | AS-14124 | Sodium hydrogen-5-sul...
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  9. Sodium 3-sulfobenzoate
      Grade & Purity: 
    • ≥97%
    Cas Number: 17625-03-5        EC Number: 241-602-5        Compound CID:  23668512
    Formula:  C7H5NaO5S        Molecular Weight: 224.17
    IUPAC Name:  sodium;3-sulfobenzoate
    SMILES:  C1=CC(=CC(=C1)S(=O)(=O)O)C(=O)[O-].[Na+]
    InChIKey: KQHKITXZJDOIOD-UHFFFAOYSA-M
    InChI:  InChI=1S/C7H6O5S.Na/c8-7(9)5-2-1-3-6(4-5)13(10,11)12;/h1-4H,(H,8,9)(H,10,11,12);/q;+1/p-1
    Synonyms: FT-0616387 | S0126 | M-sulfobenzoic acid, s-sodium salt | Benzoic acid, 3-sulfo-, monosodium salt | C7H5NaO5S | EINEC...
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  10. 5-Sulfosalicylic acid dihydrate
    Cas Number: 5965-83-3        EC Number: 202-555-6        Compound CID:  2723734
    Formula:  C7H6O6S·2H2O        Molecular Weight: 254.21
    IUPAC Name:  2-hydroxy-5-sulfobenzoic acid;dihydrate
    SMILES:  C1=CC(=C(C=C1S(=O)(=O)O)C(=O)O)O.O.O
    InChIKey: BHDKTFQBRFWJKR-UHFFFAOYSA-N
    InChI:  InChI=1S/C7H6O6S.2H2O/c8-6-2-1-4(14(11,12)13)3-5(6)7(9)10;;/h1-3,8H,(H,9,10)(H,11,12,13);2*1H2
    Synonyms: 5965-83-3|5-Sulfosalicylic acid dihydrate|2-hydroxy-5-sulfobenzoic acid dihydrate|sulfosalicylic acid dihydrate|Benzo...
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  11. 5-Sulfosalicylic acid dihydrate
      Grade & Purity: 
    • ACS
      •
    • ≥99%
    Cas Number: 5965-83-3        EC Number: 202-555-6        Compound CID:  2723734
    Formula:  C7H6O6S·2H2O        Molecular Weight: 254.21
    IUPAC Name:  2-hydroxy-5-sulfobenzoic acid;dihydrate
    SMILES:  C1=CC(=C(C=C1S(=O)(=O)O)C(=O)O)O.O.O
    InChIKey: BHDKTFQBRFWJKR-UHFFFAOYSA-N
    InChI:  InChI=1S/C7H6O6S.2H2O/c8-6-2-1-4(14(11,12)13)3-5(6)7(9)10;;/h1-3,8H,(H,9,10)(H,11,12,13);2*1H2
    Synonyms: SULFOSALICYLIC ACID DIHYDRATE [MI] | Salicylic acid, 5-sulfo-, dihydrate | 2-Hydroxy-5-sulfobenzoic-acid | Salicylic ...
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  12. 5-Sulfosalicylic acid dihydrate
      Grade & Purity: 
    • AR
      •
    • ≥99%
    Cas Number: 5965-83-3        EC Number: 202-555-6        Compound CID:  2723734
    Formula:  C7H6O6S·2H2O        Molecular Weight: 254.21
    IUPAC Name:  2-hydroxy-5-sulfobenzoic acid;dihydrate
    SMILES:  C1=CC(=C(C=C1S(=O)(=O)O)C(=O)O)O.O.O
    InChIKey: BHDKTFQBRFWJKR-UHFFFAOYSA-N
    InChI:  InChI=1S/C7H6O6S.2H2O/c8-6-2-1-4(14(11,12)13)3-5(6)7(9)10;;/h1-3,8H,(H,9,10)(H,11,12,13);2*1H2
    Synonyms: SULFOSALICYLIC ACID DIHYDRATE [MI] | Salicylic acid, 5-sulfo-, dihydrate | 2-Hydroxy-5-sulfobenzoic-acid | Salicylic ...
    Details
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