Compound: ANTHRACENE
SMILES: c12c(cc3ccccc3c1)cccc2
InChIKey: MWPLVEDNUUSJAV-UHFFFAOYSA-N
Synonyms: ANTHRACENE, 120-12-7, Paranaphthalene, Anthracin, Tetra Olive N2G, Anthracen, NSC 7958, DTXSID0023878, p-Naphthalene, CHEBI:35298, AI3-00155, EH46A1TLD7, Sterilite hop defoliant, NSC7958, NSC-7958, DTXCID203878, RefChem:6382, 204-371-1, Anthracen [German], CCRIS 767, Anthraxcene, Anthrazen, HSDB 702, Acen, EINECS 204-371-1, MFCD00001240, WLN: L C666J, NCGC00163972-01, Anthracene, pure, C14315, Anthracene, analytical standard, AN3, CAS-120-12-7, Deuterated anthracene, UNII-EH46A1TLD7, acene, acenes, antracene, Azen, 9-Anthracene, Anthracene, labeled with deuterium, Coal tar pitch volatiles:anthracene, Anthracene, Reagent, Coal tar pitch volatiles: anthracene, HRACENE, Anthracene, Practical, ANTHRACENE [MI], ANTHRACENE [HSDB], ANTHRACENE [IARC], Epitope ID:119716, EC 204-371-1, SCHEMBL7703, SCHEMBL18529, SCHEMBL18832, SCHEMBL24252, SCHEMBL70153, SCHEMBL70257, A89200_ALDRICH, 40076_SUPELCO, 48567_SUPELCO, 48647_SUPELCO, SCHEMBL102590, SCHEMBL346705, SCHEMBL417802, SCHEMBL511953, SCHEMBL512508, SCHEMBL513176, SCHEMBL559813, SCHEMBL756551, 331481_ALDRICH, 46051_RIEDEL, CHEMBL333179, SCHEMBL1395642, SCHEMBL1921671, SCHEMBL2408380, SCHEMBL2408448, SCHEMBL2409852, SCHEMBL3922969, SCHEMBL5557869, SCHEMBL6538069, SCHEMBL6538141, SCHEMBL6860163, SCHEMBL9507625, Anthracene, puriss., 99.0%, SCHEMBL17044566, SCHEMBL17044573, SCHEMBL17044574, SCHEMBL17044576, SCHEMBL17044577, SCHEMBL17044583, SCHEMBL17044586, SCHEMBL17044587, SCHEMBL17044589, SCHEMBL17044590, SCHEMBL17044591, SCHEMBL17044598, SCHEMBL17044599, SCHEMBL17044601, SCHEMBL17044604, SCHEMBL17044606, SCHEMBL17044609, SCHEMBL17044612, SCHEMBL17044613, SCHEMBL17044617, SCHEMBL17044623, SCHEMBL17044625, SCHEMBL17044627, SCHEMBL17044628, SCHEMBL17044629, SCHEMBL19610463, SCHEMBL29352043, 10580_FLUKA, 34F - WFD F, Anthracene, reagent grade, 97%, CHEBI:35297, MSK4303, Anthracene, zone-refined, >=99%, 141062_SIAL, Anthracene, ReagentPlus(R), 99%, Anthracene (purified by sublimation), Tox21_202226, Tox21_300014, Anthracene, sublimed grade, >=99%, BDBM50060894, SBB058663, STK398386, AKOS000119970, AC-5799, EBC-430048, FA01372, Anthracene 10 microg/mL in Acetonitrile, NCGC00163972-02, NCGC00163972-03, NCGC00254204-01, NCGC00259775-01, 54261-80-2, Anthracene 100 microg/mL in Acetonitrile, AS-14635, ST093055, A0405, A0495, A0992, A3437, NS00010699, EN300-18023, Anthracene Zone Refined (number of passes:30), D88363, Anthracene, vial of 250 mg, analytical standard, Anthracene, Zone Refined (number of passes:30), Q422152, Anthracene, certified reference material, TraceCERT(R), Anthracene, suitable for scintillation, >=99.0% (GC), F0001-0328, ANTHRACENE (1,2,3,4,5,6,7,8,9,10-D10), InChI=1/C14H10/c1-2-6-12-10-14-8-4-3-7-13(14)9-11(12)5-1/h1-10, 25135-15-3
Theoretical properties:
molecular_formula: C14H10
molecular_weight: 178.23 g/mol
exact_mass: 178.078250319 g/mol
formal_charge: 0
hydrogen_bond_donor_count: 0
hydrogen_bond_acceptor_count: 0
rotatable_bond_count: 0
heavy_atom_count: 14
isotope_atom_count: 0
covalently_bonded_unit_count: 1
Physical properties:
physical_state: Monoclinic plates from alcohol recrystallization; when pure, colorless with violet fluorescence
color: Monoclinic plates from alcohol recrystallization; when pure, colorless with violet fluorescence
odor: Weak aromatic odor
boiling_point: 644 °F at 760 mmHg (corrected); 439.7 °F at 53 mmHg, sublimes (NTP, 1992)
melting_point: 421 to 424 °F (NTP, 1992)
density: 1.24 at 68 °F (USCG, 1999) - Denser than water; will sink
solubility: less than 1 mg/mL at 68 °F (NTP, 1992)
flash_point: 250 °F (NTP, 1992)
vapor_pressure: 1 mmHg at 293 °F (sublimes) (NTP, 1992)
Descriptions:
pubchem: Anthracene can cause cancer according to California Labor Code and the World Health Organization's International Agency for Research on Cancer (IARC).
chebi: A polycyclic aromatic hydrocarbon consisting of fused benzene rings in a rectilinear arrangement.
chembl: ANTHRACENE is a small molecule listed in the ChEMBL database but has not progressed to an approved clinical phase.
wikipedia: Anthracene is a solid polycyclic aromatic hydrocarbon (PAH) of formula C14H10, consisting of three fused benzene rings. It is a component of coal tar. Anthracene is used in the production of the red dye alizarin and other dyes, as a scintillator to detect high energy particles, as production of pharmaceutical drugs. Anthracene is colorless but exhibits a blue (400–500 nm peak) fluorescence under ultraviolet radiation.