Basic Information | Post buying leads | Suppliers |
Name |
3-Aminophenol hemisulfate |
EINECS | 269-475-1 |
CAS No. | 68239-81-6 | Density | N/A |
PSA | 175.48000 | LogP | 3.53920 |
Solubility | N/A | Melting Point |
122-123oC |
Formula | 2(C6H7NO).H2SO4 | Boiling Point | 298.6 °C at 760 mmHg |
Molecular Weight | 316.33 | Flash Point | 116.4 °C |
Transport Information | N/A | Appearance | N/A |
Safety | Risk Codes | N/A | |
Molecular Structure | Hazard Symbols | N/A | |
Synonyms |
3-Amino-1-hydroxybenzene;Bis((3-hydroxyphenyl)ammonium) sulphate;Phenol, 3-amino-;BASF ursol EG;Phenol, 3-amino-, sulfate (2:1) (salt);591-27-5;3-Aminophenol sulfate;3-aminophenol; sulfuric acid;38171-54-9;C.I. Oxidation Base 7;m-Aminofenol [Czech];CI 76545;m-Aminophenol [UN2512] [Poison];m-Aminophenol sulfate;3-Aminophenol, hemisulfate;CI Oxidation Base 7;51-81-0;Phenol, m-amino-;Meta Amino Phenol Sulphate; |
The CAS register number of 3-Aminophenol hemisulfate is 68239-81-6. It also can be called as Bis[(3-hydroxyphenyl)ammonium] sulphate and the IUPAC name about this chemical is 3-aminophenol; sulfuric acid. The molecular formula about this chemical is 2(C6H7NO).H2SO4 and the molecular weight is 316.33. If you want to store this chemical, please keep it in a sealed container and away from light. This chemical can be used in organic synthesis and can be used as intermediates.
Physical properties about 3-Aminophenol hemisulfate are: (1)ACD/LogP: 0.34; (2)ACD/LogD (pH 5.5): 0.32; (3)ACD/LogD (pH 7.4): 0.34; (4)ACD/BCF (pH 5.5): 1.01; (5)ACD/BCF (pH 7.4): 1.06; (6)ACD/KOC (pH 5.5): 34.64; (7)ACD/KOC (pH 7.4): 36.34; (8)#H bond acceptors: 2; (9)#H bond donors: 3; (10)#Freely Rotating Bonds: 2; (11)Polar Surface Area: 12.47Å2; (12)Flash Point: 116.4 °C; (13)Enthalpy of Vaporization: 56 kJ/mol; (14)Boiling Point: 298.6 °C at 760 mmHg; (15)Vapour Pressure: 0.000709 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: O=S(=O)(O)O.Oc1cccc(N)c1.Oc1cccc(N)c1
(2)InChI: InChI=1/2C6H7NO.H2O4S/c2*7-5-2-1-3-6(8)4-5;1-5(2,3)4/h2*1-4,8H,7H2;(H2,1,2,3,4)
(3)InChIKey: TVBNHNUPRXSKHS-UHFFFAOYAP
(4)Std. InChI: InChI=1S/2C6H7NO.H2O4S/c2*7-5-2-1-3-6(8)4-5;1-5(2,3)4/h2*1-4,8H,7H2;(H2,1,2,3,4)
(5)Std. InChIKey: TVBNHNUPRXSKHS-UHFFFAOYSA-N