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CAS No.: | 1134-36-7 |
---|---|
Name: | 2-AMINO-4-PHENYLPHENOL |
Article Data: | 7 |
Molecular Structure: | |
Formula: | C12H11NO |
Molecular Weight: | 185.225 |
Synonyms: | 4-Biphenylol,3-amino- (8CI);Phenol, 2-amino-4-phenyl- (6CI,7CI);2-Amino-4-phenylphenol;2-Hydroxy-5-phenylaniline;3-Amino-4-biphenylol;4-Phenyl-2-aminophenol;NSC 7950; |
EINECS: | 214-484-8 |
Density: | 1.191 g/cm3 |
Melting Point: | 198-202 °C(lit.) |
Boiling Point: | 356 °C at 760 mmHg |
Flash Point: | 169.1 °C |
Hazard Symbols: | Xi |
Risk Codes: | 36/37/38 |
Safety: | 26-36 |
PSA: | 46.25000 |
LogP: | 3.22260 |
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The (1,1'-Biphenyl)-4-ol, 3-amino-, with the cas register number 1134-36-7, has the systematic name of
3-aminobiphenyl-4-ol. This chemical belongs to the products classes of Organic Building Blocks; Oxygen Compounds; Phenols.
The characteristics of this chemical are as following: (1)ACD/LogP: 1.88; (2)ACD/LogD (pH 5.5): 1.84; (3)ACD/LogD (pH 7.4): 1.88; (4)ACD/BCF (pH 5.5): 14.35; (5)ACD/BCF (pH 7.4): 15.71; (6)ACD/KOC (pH 5.5): 227.82; (7)ACD/KOC (pH 7.4): 249.33; (8)#H bond acceptors: 2; (9)#H bond donors: 3; (10)#Freely Rotating Bonds: 3; (11)Polar Surface Area: 12.47; (12)Index of Refraction: 1.653; (13)Molar Refractivity: 56.96 cm3; (14)Molar Volume: 155.4 cm3; (15)Polarizability: 22.58 ×10-24 cm3; (16)Surface Tension: 54 dyne/cm; (17)Density: 1.191 g/cm3; (18)Flash Point: 169.1 °C; (19)Enthalpy of Vaporization: 62.5 kJ/mol; (20)Boiling Point: 356 °C at 760 mmHg; (21)Vapour Pressure: 1.46E-05 mmHg at 25°C; (22)Exact Mass: 185.084064; (23)MonoIsotopic Mass: 185.084064; (24)Topological Polar Surface Area: 46.2; (25)Heavy Atom Count: 14; (26)Complexity: 177.
Use of (1,1'-Biphenyl)-4-ol, 3-amino-: (1,1'-Biphenyl)-4-ol, 3-amino- could react with dibromo-triphenyl-l5-phosphane to produce (2-Hydroxy-5-phenyl-phenylimino)triphenylphosphoran, with the field of 61%.
When you deal with this chemical, you should be very cautious. Being a kind of irritant chemical to eyes, respiratory system and skin, it may cause inflammation to the skin or other mucous. Therefore, you should take the following instructions to protect yourself. Wear suitable protective clothing, and if in case of contacting with eyes, rinse immediately with plenty of water and seek medical advice.
In addition, you could convert the following datas into the molecular structure:
(1)SMILES:Oc2ccc(c1ccccc1)cc2N
(2)InChI:InChI=1/C12H11NO/c13-11-8-10(6-7-12(11)14)9-4-2-1-3-5-9/h1-8,14H,13H2
(3)InChIKey:IGIDZGNPFWGICD-UHFFFAOYAH
Below are the toxicity information of this chemical:
Organism | Test Type | Route | Reported Dose (Normalized Dose) | Effect | Source |
---|---|---|---|---|---|
guinea pig | LD50 | skin | > 1gm/kg (1000mg/kg) | National Technical Information Service. Vol. OTS0540931, | |
mouse | LD50 | oral | 2262mg/kg (2262mg/kg) | National Technical Information Service. Vol. OTS0540931, | |
rat | LD50 | oral | 2262mg/kg (2262mg/kg) | National Technical Information Service. Vol. OTS0540931, |