1@chemical{108-95-2, 2 cas = {108-95-2}, 3 formula = {C_6H_6O}, 4 chemspider = {971}, 5 pubchem = {996}, 6 mw = {94.113}, 7 mass = {94.042}, 8 IUPAC = {phenol}, 9 name = {phenol}, 10 name:en = {phenol}, 11 name:nl = {fenol}, 12 name:pl = {fenol}, 13 name:it = {fenolo}, 14 name:fr = {phénol}, 15 name:de = {phenole}, 16 synonyms = {carbolic acid; hydroxybenzene; monohydroxybenzene; phenic acid; 17 phenyl alcohol; benzophenol; carbolicum acidum; phenic alcohol; 18 phenyl hydroxide; phenylic acid; carbolic oil; carbolsaeure;}, 19 molarvolume = {87.9 cm³}, 20 mp = {42°C}, 21 bp = {181°C}, 22 density = {1.071 g/ml}, 23 ionization = {8.5 eV}, 24 vaporpressure = {0.4 mmHg}, 25 refractiveindex = {1.553}, 26 surfacetension = {41.0 dyne/cm}, 27 appearance = {Colorless to light-pink, crystalline solid with a sweet, acrid odor}, 28 chemical = {SIX,ROT,B,EB135,+SR1,RZ1=OH}, 29 InChI={1S/C6H6O/c7-6-4-2-1-3-5-6/h1-5,7H}, 30 SMILES={C1=CC=C(C=C1)O}, 31 jmol = {971.mol}, 32 rendered = {971.pdf}, 33} 34 35@chemical{24599-57-3, 36 cas = {24599-57-3}, 37 formula = {C_6H_6O}, 38 chemspider = {124484}, 39 pubchem = {141125}, 40 mw = {94.113}, 41 mass = {94.042}, 42 IUPAC = {cyclohexa-2,4-dien-1-one}, 43 name = {cyclohexadienone}, 44 name:en = {2,4-cyclohexadien-1-one}, 45 name:fr = {2,4-cyclohexadién-1-one}, 46 name:de = {2,4-cyclohexadien-1-on}, 47 density = {1.1 g/ml}, 48 bp = {182.4°C}, 49 refractiveindex = {1.515}, 50 surfacetension = {37.2 dyne/cm}, 51 molarvolume = {89.5 cm³}, 52 chemical = {SIX,ROT,B,EB35,+DR1,RZ1=O}, 53 InChI={1S/C6H6O/c7-6-4-2-1-3-5-6/h1-4H,5H2}, 54 SMILES = {C1C=CC=CC1=O}, 55 jmol = {124484.mol}, 56 rendered = {124484.pdf}, 57} 58 59@chemical{566-33-5, 60 cas = {566-33-5}, 61 formula = {C_6H_6O}, 62 pubchem = {138558}, 63 chemspider = {122176}, 64 mw = {94.113}, 65 mass = {94.042}, 66 IUPAC = {cyclohexa-2,5-dien-1-one}, 67 name = {2,5-cyclohexadienone}, 68 name:en = {2,5-cyclohexadien-1-one}, 69 name:fr = {2,5-cyclohexadién-1-one}, 70 name:de = {2,5-cyclohexadien-1-on}, 71 density = {1.1 g/ml}, 72 bp = {173°C}, 73 refractiveindex = {1.515}, 74 surfacetension = {37.2 dyne/cm}, 75 molarvolume = {89.5 cm³}, 76 chemical = {SIX,ROT,B,EB25,+DR1,RZ1=O}, 77 InChI = {1S/C6H6O/c7-6-4-2-1-3-5-6/h2-5H,1H2}, 78 SMILES = {C1C=CC(=O)C=C1}, 79 jmol = {122176.mol}, 80 rendered = {122176.pdf}, 81} 82 83@chemical{291-70-3, 84 cas = {291-70-3}, 85 chemspider = {4953942}, 86 pubchem = {6451477}, 87 formula = {C_6H_6O}, 88 mw = {94.113}, 89 mass = {94.042}, 90 IUPAC = {oxepine}, 91 name = {oxepin}, 92 name:en = {Oxacycloheptatriene}, 93 name:fr = {oxépine}, 94 name:de = {oxepin}, 95 density = {1.0 g/ml}, 96 bp = {183.1°C}, 97 refractiveindex = {1.502}, 98 surfacetension = {39.9 dyne/cm}, 99 molarvolume = {95.1 cm³}, 100 chemical = {SEVEN,ROT,+SB7,-SB1,B2..6,EB246,Z1=O}, 101 InChI={1S/C6H6O/c1-2-4-6-7-5-3-1/h1-6H}, 102 SMILES = {C1=CC=COC=C1}, 103 jmol = {4953942.mol}, 104 rendered = {4953942.pdf}, 105} 106 |