Compound: Benzo[b]fluoranthene
SMILES: c12c3c4c(-c5ccccc5-c4ccc3)cc1cccc2
InChIKey: FTOVXSOBNPWTSH-UHFFFAOYSA-N
Synonyms: Benzo[b]fluoranthene, 205-99-2, BENZO(B)FLUORANTHENE, Benz[e]acephenanthrylene, 3,4-Benzfluoranthene, benzo[e]acephenanthrylene, 2,3-Benzofluoranthene, 3,4-Benzofluoranthene, 2,3-Benzfluoranthene, 2,3-Benzofluoranthrene, Benz(e)acephenanthrylene, Benzo[e]fluoranthene, Benzo(e)fluoranthene, 3,4-Benz(e)acephenanthrylene, 3,4-Benz[e]acephenanthrylene, 4,5-Benzofluoranthene, DTXSID0023907, FJO154KG1X, NSC-89265, DTXCID903907, CHEBI:34565, NSC89265, pentacyclo[10.7.1.02,7.08,20.013,18]icosa-1(19),2(7),3,5,8(20),9,11,13,15,17-decaene, benzo(e)acephenanthrylene, pentacyclo(10.7.1.02,7.08,20.013,18)icosa-1(19),2(7),3,5,8(20),9,11,13,15,17-decaene, RefChem:118187, 205-911-9, pentacyclo(10.7.1.02,7.08,20.013,18)icosa-1(19),2,4,6,8(20),9,11,13,15,17-decaene, B(b)F, NSC 89265, MFCD00010582, 1397206-82-4, BF, CCRIS 72, CAS-205-99-2, HSDB 4035, Benzo (b) fluoranthene, EINECS 205-911-9, UNII-FJO154KG1X, BRN 1872553, Benz[b]fluoranthene, benz[e]acephenanthrylen, 3,4-Benzofluoranthrene, BENZO(B)FLUORANTHRENE, Benzo[b]fluoranthene, 98%, Benzo[b]fluoranthene 10 microg/mL in Cyclohexane, Benzo[b]fluoranthene 10 microg/mL in Acetonitrile, MLS002415713, BIDD:ER0409, SCHEMBL175779, SCHEMBL456762, SCHEMBL456763, Benzo[b]fluoranthene 100 microg/mL in Acetonitrile, SCHEMBL3268462, CHEMBL1337502, SCHEMBL17063436, SCHEMBL17063438, SCHEMBL29373899, SCHEMBL29503670, SCHEMBL30626366, MSK4306, BENZO(B)FLUORANTHENE [HSDB], BENZO(B)FLUORANTHENE [IARC], Tox21_202381, Tox21_300289, AKOS015902955, CS-W012616, WLN: L C65 K666 1A TJ, Benzo[b]fluoranthene, analytical standard, NCGC00090866-01, NCGC00090866-02, NCGC00090866-03, NCGC00090866-04, NCGC00254223-01, NCGC00259930-01, SMR001370895, DB-045304, B2982, NS00006596, ST45000855, Benzo[b]fluoranthene 10 Axg/mL in Acetonitrile, Benzo[b]fluoranthene 10 Axg/mL in Cyclohexane, D78396, Benzo[b]fluoranthene 100 Axg/mL in Acetonitrile, Q2380192, Benzo[b]fluoranthene, vial of 1 g, analytical standard, Benzo[b]fluoranthene, certified reference material, TraceCERT(R), Benz[e]acephenanthrylene, 3,4-Benzofluoranthene, BbF, NSC 89265, Benzo[e]fluoranthene, 3,4-Benz[e]acephenanthrylene, 3,4-Benzfluoranthene, 2,3-Benzfluoranthene, Benzo[b]fluoranthene, Benzo[b]fluoranthene, 3,4-Benzfluoranthene, 2,3-Benzfluoranthene, NSC 89265,Benz[e]acephenanthrylene, BbF, 3,4-Benzofluoranthene, 3,4-Benz[e]acephenanthrylene, Benzo[e]fluoranthene, Benzo[b]fluoranthene,Benz[e]acephenanthrylene, 3,4-Benzfluoranthene, 2,3-Benzfluoranthene, 3,4-Benzofluoranthene, NSC 89265, Benzo[e]fluoranthene, 3,4-Benz[e]acephenanthrylene, BbF, Benzo[e]fluoranthene, 3,4-Benz[e]acephenanthrylene, NSC 89265, 2,3-Benzfluoranthene, BbF,Benz[e]acephenanthrylene, 3,4-Benzofluoranthene, 3,4-Benzfluoranthene, Benzo[b]fluoranthene, InChI=1/C20H12/c1-2-7-14-13(6-1)12-19-16-9-4-3-8-15(16)18-11-5-10-17(14)20(18)19/h1-12, pentacyclo[10.7.1.0^{2,7.0^{8,20.0^{13,18]icosa-1(19),2(7),3,5,8(20),9,11,13,15,17-decaene
Theoretical properties:
molecular_formula: C20H12
molecular_weight: 252.3 g/mol
exact_mass: 252.093900383 g/mol
formal_charge: 0
hydrogen_bond_donor_count: 0
hydrogen_bond_acceptor_count: 0
rotatable_bond_count: 0
heavy_atom_count: 20
isotope_atom_count: 0
covalently_bonded_unit_count: 1
Physical properties:
physical_state: Needles from benzene
color: Needles from benzene
boiling_point: 481 °C
melting_point: 325 to 329 °F (NTP, 1992)
solubility: less than 1 mg/mL at 66 °F (NTP, 1992)
vapor_pressure: 0.0000005 [mmHg]
Descriptions:
pubchem: Benzo[b]fluoranthene can cause cancer according to an independent committee of scientific and health experts.
chebi: An <em>ortho</em>- and <em>peri</em>-fused polycyclic arene that consists of a benzene ring fused with a acephenanthrylene ring.
chembl: BENZO[B]FLUORANTHENE is a small molecule listed in the ChEMBL database but has not progressed to an approved clinical phase.
wikipedia: Benzo[k]fluoranthene is an organic compound with the chemical formula C20H12. Classified as a polycyclic aromatic hydrocarbon (PAH), it forms pale yellow needles or crystals, and is poorly soluble in most solvents. Impure samples can appear off white.  Closely related isomeric compounds include benzo(a)fluoranthene,  benzo(b)fluoranthene,  benzo(e)fluoranthene, and  benzo(j)fluoranthene.