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Benzenoids

Description:

Aromatic compounds containing one or more benzene rings.
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Items 1-12 of 41,883

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  1. Phenol
    Cas Number: 108-95-2        EC Number: 203-632-7
    Formula:  C6H6O        Molecular Weight: 94.11
    IUPAC Name:  phenol
    SMILES:  C1=CC=C(C=C1)O
    InChIKey: ISWSIDIOOBJBQZ-UHFFFAOYSA-N
    InChI:  InChI=1S/C6H6O/c7-6-4-2-1-3-5-6/h1-5,7H
  2. 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
  3. Polyanetholesulfonic acid sodium salt
    Cas Number: 55963-78-5
    Formula:  (C10H11NaO4S)n       
    IUPAC Name:  sodium;1-methoxy-4-prop-1-enylbenzene;sulfite
    SMILES:  CC=CC1=CC=C(C=C1)OC.[O-]S(=O)[O-].[Na+]
    InChIKey: JKJBFNAERWARKW-UHFFFAOYSA-L
    InChI:  InChI=1S/C10H12O.Na.H2O3S/c1-3-4-9-5-7-10(11-2)8-6-9;;1-4(2)3/h3-8H,1-2H3;;(H2,1,2,3)/q;+1;/p-2
  4. Z-D-Dap-OH
      Grade & Purity: 
    • ≥98%
    Cas Number: 62234-37-1
    Formula:  C11H14N2O4        Molecular Weight: 238.24
    IUPAC Name:  (2R)-3-amino-2-(phenylmethoxycarbonylamino)propanoic acid
    SMILES:  C1=CC=C(C=C1)COC(=O)NC(CN)C(=O)O
    InChIKey: FOXRXVSTFGNURG-SECBINFHSA-N
    InChI:  InChI=1S/C11H14N2O4/c12-6-9(10(14)15)13-11(16)17-7-8-4-2-1-3-5-8/h1-5,9H,6-7,12H2,(H,13,16)(H,14,15)/t9-/m1/s1
    Synonyms: (R)-3-Amino-2-benzyloxycarbonylamino-propionic acid | (R)-3-Amino-2-Cbz-Aminopropanoic Acid | (R)-3-AMINO-2-(CBZ-AMIN...
  5. Pentadecylbenzene
      Grade & Purity: 
    • ≥96%
    Cas Number: 2131-18-2        Compound CID:  16476
    Formula:  C21H36        Molecular Weight: 288.52
    IUPAC Name:  pentadecylbenzene
    SMILES:  CCCCCCCCCCCCCCCC1=CC=CC=C1
    InChIKey: JIRNEODMTPGRGV-UHFFFAOYSA-N
    InChI:  InChI=1S/C21H36/c1-2-3-4-5-6-7-8-9-10-11-12-13-15-18-21-19-16-14-17-20-21/h14,16-17,19-20H,2-13,15,18H2,1H3
  6. 3-Pentadecylphenol
      Grade & Purity: 
    • ≥90%(mixture of isomers)
    Cas Number: 501-24-6
    Formula:  C21H36O        Molecular Weight: 304.52
    IUPAC Name:  3-pentadecylphenol
    SMILES:  CCCCCCCCCCCCCCCC1=CC(=CC=C1)O
    InChIKey: PTFIPECGHSYQNR-UHFFFAOYSA-N
    InChI:  InChI=1S/C21H36O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-16-20-17-15-18-21(22)19-20/h15,17-19,22H,2-14,16H2,1H3
  7. Carmine solution
    Cas Number: 2611-82-7        EC Number: 220-036-2
    Formula:  C20H11N2Na3O10S3        Molecular Weight: 604.47
    IUPAC Name:  trisodium;7-hydroxy-8-[(4-sulfonatonaphthalen-1-yl)diazenyl]naphthalene-1,3-disulfonate
    SMILES:  C1=CC=C2C(=C1)C(=CC=C2S(=O)(=O)[O-])N=NC3=C(C=CC4=CC(=CC(=C43)S(=O)(=O)[O-])S(=O)(=O)[O-])O.[Na+].[Na+].[Na+]
    InChIKey: SWGJCIMEBVHMTA-UHFFFAOYSA-K
    InChI:  InChI=1S/C20H14N2O10S3.3Na/c23-16-7-5-11-9-12(33(24,25)26)10-18(35(30,31)32)19(11)20(16)22-21-15-6-8-17(34(27,28)29)14-4-2-1-3-13(14)15;;;/h1-10,23H,(show more
  8. Propiconazole
      Grade & Purity: 
    • ≥95%(mixture of isomers)
    Cas Number: 60207-90-1        EC Number: 262-104-4
    Formula:  C15H17Cl2N3O2        Molecular Weight: 342.22
    IUPAC Name:  1-[[2-(2,4-dichlorophenyl)-4-propyl-1,3-dioxolan-2-yl]methyl]-1,2,4-triazole
    SMILES:  CCCC1COC(O1)(CN2C=NC=N2)C3=C(C=C(C=C3)Cl)Cl
    InChIKey: STJLVHWMYQXCPB-UHFFFAOYSA-N
    InChI:  InChI=1S/C15H17Cl2N3O2/c1-2-3-12-7-21-15(22-12,8-20-10-18-9-19-20)13-5-4-11(16)6-14(13)17/h4-6,9-10,12H,2-3,7-8H2,1H3
  9. Transfluthrin
      Grade & Purity: 
    • ≥95%
    Cas Number: 118712-89-3        EC Number: 405-060-5
    Formula:  C15H12Cl2F4O2        Molecular Weight: 371.15
    IUPAC Name:  (2,3,5,6-tetrafluorophenyl)methyl (1R,3S)-3-(2,2-dichloroethenyl)-2,2-dimethylcyclopropane-1-carboxylate
    SMILES:  CC1(C(C1C(=O)OCC2=C(C(=CC(=C2F)F)F)F)C=C(Cl)Cl)C
    InChIKey: DDVNRFNDOPPVQJ-HQJQHLMTSA-N
    InChI:  InChI=1S/C15H12Cl2F4O2/c1-15(2)7(3-10(16)17)11(15)14(22)23-5-6-12(20)8(18)4-9(19)13(6)21/h3-4,7,11H,5H2,1-2H3/t7-,11+/m1/s1
  10. N-(3-trimethylammoniumpropyl)-4-(6-(4-(diethylamino)phenyl)hexatrienyl)pyridinium dibromide
    Cas Number: 872979-87-8        Compound CID:  53426329
    Formula:  C27H39Br2N3        Molecular Weight: 565.427
    IUPAC Name:  3-[4-[6-[4-(diethylamino)phenyl]hexa-1,3,5-trienyl]pyridin-1-ium-1-yl]propyl-trimethylazanium;dibromide
    SMILES:  CCN(CC)C1=CC=C(C=C1)C=CC=CC=CC2=CC=[N+](C=C2)CCC[N+](C)(C)C.[Br-].[Br-]
    InChIKey: AZJASRWHFPDMHB-UHFFFAOYSA-L
    InChI:  InChI=1S/C27H39N3.2BrH/c1-6-29(7-2)27-17-15-25(16-18-27)13-10-8-9-11-14-26-19-22-28(23-20-26)21-12-24-30(3,4)5;;/h8-11,13-20,22-23H,6-7,12,21,24H2,1-5show more
    Synonyms: N-(3-trimethylammoniumpropyl)-4-(6-(4-(diethylamino)phenyl)hexatrienyl)pyridinium bromide | fm 5-95 | n-(3-trimethyla...
  11. N-(3-triethylammoniumpropyl)-4-(4-(4-(diethylamino)phenyl)butadienyl)pyridinium dibromide
    Cas Number: 161433-30-3        Compound CID:  11261722
    Formula:  C28H43Br2N3        Molecular Weight: 581.47
    IUPAC Name:  3-[4-[(1E,3E)-4-[4-(diethylamino)phenyl]buta-1,3-dienyl]pyridin-1-ium-1-yl]propyl-triethylazanium;dibromide
    SMILES:  CCN(CC)C1=CC=C(C=C1)C=CC=CC2=CC=[N+](C=C2)CCC[N+](CC)(CC)CC.[Br-].[Br-]
    InChIKey: CPDHBIMOKOHWDD-UHFFFAOYSA-L
    InChI:  InChI=1S/C28H43N3.2BrH/c1-6-30(7-2)28-18-16-26(17-19-28)14-11-12-15-27-20-23-29(24-21-27)22-13-25-31(8-3,9-4)10-5;;/h11-12,14-21,23-24H,6-10,13,22,25Hshow more
    Synonyms: RH 414 | UNII-IT32S296PE | RH-414 | Pyridinium, 4-(4-(4-(diethylamino)phenyl)-1,3-butadien-1-yl)-1-(3-(triethylammoni...
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