Benzopyrenes

Description:

Organic compounds containing a benzene fused to a pyrene(benzo[def]phenanthrene) ring system.

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  1. C.I. Vat Green 1
    CAS: 128-58-5 PubChem CID: 31410 Formula: C36H20O4 Molecular Weight: 516.56
    Out of Stock Item #: C1366905
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    Technical Identifiers
    IUPAC Name
    30,34-dimethoxynonacyclo[18.10.2.22,5.03,16.04,13.06,11.017,31.022,27.028,32]tetratriaconta-1(30),2(34),3(16),4(13),5(33),6,8,10,14,17(31),18,20(32),2show more
    SMILES
    COC1=C2C3=C(C=CC4=C3C(=C1)C5=CC=CC=C5C4=O)C6=C7C2=C(C=C8C7=C(C=C6)C(=O)C9=CC=CC=C98)OC
    InChIKey
    JXUKQCUPTNLTCS-UHFFFAOYSA-N
    InChI
    1S/C36H20O4/c1-39-27-15-25-17-7-3-5-9-21(17)35(37)23-13-11-19-20-12-14-24-30-26(18-8-4-6-10-22(18)36(24)38)16-28(40-2)34(32(20)30)33(27)31(19)29(23)25show more
  2. Fullerene C70
    CAS: 115383-22-7 Formula: C70 Molecular Weight: 840.75
    Solid ≥99.5%
    In Stock Item #: F757064
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    IUPAC Name
    (C70-D5h(6))[5,6]fullerene
    SMILES
    C12=C3C4=C5C6=C7C8=C9C%10=C%11C%12=C%13C%10=C%10C8=C5C1=C%10C1=C%13C5=C8C1=C2C1=C3C2=C3C%10=C%13C%14=C3C1=C8C1=C3C5=C%12C5=C8C%11=C%11C9=C7C7=C9C6=C4Cshow more
    InChIKey
    ATLMFJTZZPOKLC-UHFFFAOYSA-N
    InChI
    1S/C70/c1-2-22-5-6-24-13-14-26-11-9-23-4-3(21(1)51-52(22)54(24)55(26)53(23)51)33-31(1)61-35-7-8-27-15-16-29-19-20-30-18-17-28-12-10(25(7)56-57(27)59(2show more
    Synonyms
    Buckminsterfullerene C70 C70 Carbon C70
  3. Anthra[9,1,2-cde]benzo[rst]pentaphene-5,10-dione
    CAS: 116-71-2 PubChem CID: 8317 Formula: C34H16O2 Molecular Weight: 456.51
    Strength ≥290%
    Out of Stock Item #: A693411
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    IUPAC Name
    nonacyclo[18.10.2.22,5.03,16.04,13.06,11.017,31.022,27.028,32]tetratriaconta-1(31),2,4,6,8,10,13,15,17,19,22,24,26,28(32),29,33-hexadecaene-12,21-dionshow more
    SMILES
    C1=CC=C2C(=C1)C3=C4C(=CC=C5C4=C(C=C3)C6=C7C5=CC=C8C7=C(C=C6)C9=CC=CC=C9C8=O)C2=O
    InChIKey
    YKSGNOMLAIJTLT-UHFFFAOYSA-N
    InChI
    1S/C34H16O2/c35-33-25-7-3-1-5-17(25)19-9-11-21-22-12-10-20-18-6-2-4-8-26(18)34(36)28-16-14-24(30(22)32(20)28)23-13-15-27(33)31(19)29(21)23/h1-16H
  4. Ovalene
    CAS: 190-26-1 PubChem CID: 67446 Formula: C32H14 Molecular Weight: 398.45
    Out of Stock Item #: O694190
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    IUPAC Name
    ovalene
    SMILES
    C1=CC2=C3C4=C1C=CC5=CC6=C7C8=C(C=CC9=C8C1=C(C=C9)C=C(C3=C1C7=C54)C=C2)C=C6
    InChIKey
    LSQODMMMSXHVCN-UHFFFAOYSA-N
    InChI
    1S/C32H14/c1-2-16-6-10-20-14-22-12-8-18-4-3-17-7-11-21-13-19-9-5-15(1)23-24(16)28(20)32-30(22)26(18)25(17)29(21)31(32)27(19)23/h1-14H
  5. C.I. Vat Green 9
    CAS: 107927-52-6 PubChem CID: 80733 Formula: C34H14N2O6 Molecular Weight: 546.5
    Out of Stock Item #: C667982
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    Technical Identifiers
    IUPAC Name
    9,24-dinitrononacyclo[18.10.2.22,5.03,16.04,13.06,11.017,31.022,27.028,32]tetratriaconta-1(31),2,4,6(11),7,9,13,15,17,19,22(27),23,25,28(32),29,33-hexshow more
    SMILES
    C1=CC2=C(C=C1[N+](=O)[O-])C(=O)C3=CC=C4C5=CC=C6C7=C(C=CC(=C57)C8=C4C3=C2C=C8)C9=C(C6=O)C=C(C=C9)[N+](=O)[O-]
    InChIKey
    KDVDMQVITMTCAH-UHFFFAOYSA-N
    InChI
    1S/C34H14N2O6/c37-33-25-11-9-23-24-10-12-26-32-20(18-4-2-16(36(41)42)14-28(18)34(26)38)6-8-22(30(24)32)21-7-5-19(31(25)29(21)23)17-3-1-15(35(39)40)13-show more
    Synonyms
    C.I. Vat Green 9 | NSC51535 | NSC-51535 | 9,24-dinitrononacyclo[18.10.2.22,5.03,16.04,13.06,11.017,31.022,27.028,32]t...
  6. hypericin
    Moligand™ ? Moligand™ — Aladdin's line of ligands and bioactive small molecules. Use for receptor, pathway, and binding studies needing defined small-molecule tools.
    Out of Stock Item #: H610890
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    Technical Identifiers
    SMILES
    CC1=CC(=O)c2c3c1c1C(=CC(=O)c4c1c1c3c3c(c2O)c(O)cc(c3c2c1c(c4O)c(O)cc2O)O)C
    InChIKey
    YDOIFHVUBCIUHF-UHFFFAOYSA-N
    InChI
    1S/C30H16O8/c1-7-3-9(31)19-23-15(7)16-8(2)4-10(32)20-24(16)28-26-18(12(34)6-14(36)22(26)30(20)38)17-11(33)5-13(35)21(29(19)37)25(17)27(23)28/h3-6,33-3show more
    Synonyms
    CCG-36081 | 1:6:8:10:11:13-hexahydroxy-3:4-dimethyl-meso-naphthodianthrene-7:14-dione | 4,5,7,4',5',7'-Hexahydroxy-2,...
  7. Benzo[e]pyrene-d₁₂
    CAS: 205440-82-0 Formula: C20H12 Molecular Weight: 264.38
    Out of Stock Item #: B472128
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    IUPAC Name
    1,2,3,4,5,6,7,8,9,10,11,12-dodecadeuteriobenzo[e]pyrene
    SMILES
    C1=CC=C2C(=C1)C3=CC=CC4=C3C5=C(C=CC=C25)C=C4
    InChIKey
    TXVHTIQJNYSSKO-AQZSQYOVSA-N
    InChI
    1S/C20H12/c1-2-8-16-15(7-1)17-9-3-5-13-11-12-14-6-4-10-18(16)20(14)19(13)17/h1-12H/i1D,2D,3D,4D,5D,6D,7D,8D,9D,10D,11D,12D
    Synonyms
    Benzo[e]pyrene-d12, 98 atom % D, 98% (CP) | Benzo[e]pyrene-d12 | Benzo[e]pyrene-1,2,3,4,5,6,7,8,9,10,11,12-d12 | F905...
  8. 7-Methylbenzo[a]pyrene
    CAS: 63041-77-0 Formula: C21H14 Molecular Weight: 266.34
    Out of Stock Item #: M472554
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    Technical Identifiers
    IUPAC Name
    7-methylbenzo[a]pyrene
    SMILES
    CC1=C2C=C3C=CC4=C5C3=C(C2=CC=C1)C=CC5=CC=C4
    InChIKey
    PYVWGNPFWVQISD-UHFFFAOYSA-N
    InChI
    1S/C21H14/c1-13-4-2-7-17-18-11-10-15-6-3-5-14-8-9-16(12-19(13)17)21(18)20(14)15/h2-12H,1H3
    Synonyms
    DTXCID7029297 | CCRIS 2440 | FT-0640864 | 7-Methylbenzo(a)pyrene | BRN 2267228 | 7-Methylbenzo[a]pyrene, 98% | Tox21_...
  9. Hypericin
    CAS: 548-04-9 EC Number: 208-941-0 Formula: C30H16O8 Molecular Weight: 504.44
    Moligand™ ? Moligand™ — Aladdin's line of ligands and bioactive small molecules. Use for receptor, pathway, and binding studies needing defined small-molecule tools. 10mM in DMSO
    In Stock Item #: H424670
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    Technical Identifiers
    IUPAC Name
    9,11,13,16,18,20-hexahydroxy-5,24-dimethyloctacyclo[13.11.1.12,10.03,8.04,25.019,27.021,26.014,28]octacosa-1(26),2,4(25),5,8,10,12,14(28),15(27),16,18show more
    SMILES
    CC1=CC(=O)C2=C(C3=C(C=C(C4=C3C5=C2C1=C6C(=CC(=O)C7=C(C8=C(C=C(C4=C8C5=C67)O)O)O)C)O)O)O
    InChIKey
    YDOIFHVUBCIUHF-UHFFFAOYSA-N
    InChI
    1S/C30H16O8/c1-7-3-9(31)19-23-15(7)16-8(2)4-10(32)20-24(16)28-26-18(12(34)6-14(36)22(26)30(20)38)17-11(33)5-13(35)21(29(19)37)25(17)27(23)28/h3-6,33-3show more
    Synonyms
    CCG-36081 | 1:6:8:10:11:13-hexahydroxy-3:4-dimethyl-meso-naphthodianthrene-7:14-dione | 4,5,7,4',5',7'-Hexahydroxy-2,...
  10. Benzo[ghi]perylene standard solution
    CAS: 191-24-2 EC Number: 205-883-8 Formula: C22H12 Molecular Weight: 276.33
    2000μg/ml in Toluene
    Out of Stock Item #: B141127
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    Technical Identifiers
    IUPAC Name
    hexacyclo[12.8.0.02,11.03,8.04,21.017,22]docosa-1(14),2(11),3(8),4,6,9,12,15,17(22),18,20-undecaene
    SMILES
    C1=CC2=C3C(=C1)C4=CC=CC5=C4C6=C(C=C5)C=CC(=C36)C=C2
    InChIKey
    GYFAGKUZYNFMBN-UHFFFAOYSA-N
    InChI
    1S/C22H12/c1-3-13-7-9-15-11-12-16-10-8-14-4-2-6-18-17(5-1)19(13)21(15)22(16)20(14)18/h1-12H
    Synonyms
    AMY7681 | H11449 | A813479 | CCRIS 784 | hexacyclo[12.8.0.02,11.03,8.04,21.017,22]docosa-1(14),2(11),3(8),4,6,9,12,15...
  11. Benzo[ghi]perylene
    CAS: 191-24-2 EC Number: 205-883-8 Formula: C22H12 Molecular Weight: 276.33
    Analytical standard ? Analytical standard — certified-purity material for quantitative calibration. Use to prepare calibration standards and validate analytical methods.
    In Stock Item #: B115103
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    Technical Identifiers
    IUPAC Name
    hexacyclo[12.8.0.02,11.03,8.04,21.017,22]docosa-1(14),2(11),3(8),4,6,9,12,15,17(22),18,20-undecaene
    SMILES
    C1=CC2=C3C(=C1)C4=CC=CC5=C4C6=C(C=C5)C=CC(=C36)C=C2
    InChIKey
    GYFAGKUZYNFMBN-UHFFFAOYSA-N
    InChI
    1S/C22H12/c1-3-13-7-9-15-11-12-16-10-8-14-4-2-6-18-17(5-1)19(13)21(15)22(16)20(14)18/h1-12H
    Synonyms
    AMY7681 | H11449 | A813479 | CCRIS 784 | hexacyclo[12.8.0.02,11.03,8.04,21.017,22]docosa-1(14),2(11),3(8),4,6,9,12,15...
  12. Benzo[a]pyrene-d12 standard solution
    CAS: 50-32-8 EC Number: 200-028-5 Formula: C20H12 Molecular Weight: 252.31
    Liquid 2000μg/ml in Toluene
    In Stock Item #: B141125
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    Technical Identifiers
    IUPAC Name
    benzo[a]pyrene
    SMILES
    C1=CC=C2C3=C4C(=CC2=C1)C=CC5=C4C(=CC=C5)C=C3
    InChIKey
    FMMWHPNWAFZXNH-UHFFFAOYSA-N
    InChI
    1S/C20H12/c1-2-7-17-15(4-1)12-16-9-8-13-5-3-6-14-10-11-18(17)20(16)19(13)14/h1-12H
    Synonyms
    3,4-Benz(a)pyrene | 3,4-Benzopirene | 3,4-Benzpyrene | Benzo(3,4)pyrene, radical ion(1+) | KBioSS_002390 | NCI60_0018...
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