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Phenol,4-amino-5-methyl-2-(1-methylethyl)-

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Name

Phenol,4-amino-5-methyl-2-(1-methylethyl)-

EINECS 214-436-6
CAS No. 1128-28-5 Density 1.055 g/cm3
PSA 46.25000 LogP 2.98740
Solubility N/A Melting Point N/A
Formula C10H15NO Boiling Point 304.6 °C at 760 mmHg
Molecular Weight 165.235 Flash Point 138 °C
Transport Information N/A Appearance N/A
Safety Risk Codes N/A
Molecular Structure Molecular Structure of 1128-28-5 (4-AMINO-2-ISOPROPYL-5-METHYLPHENOL) Hazard Symbols N/A
Synonyms

Thymol,6-amino- (6CI,7CI,8CI);

Article Data 38

Phenol,4-amino-5-methyl-2-(1-methylethyl)- Specification

The Phenol, 4-amino-5-methyl-2-(1-methylethyl)-, with the CAS registry number of 1128-28-5, is also known as 4-Amino-2-isopropyl-5-methylphenol. Its EINECS registry number is 214-436-6. This chemical's molecular formula is C10H15NO and molecular weight is 165.23. What's more, its IUPAC name is 4-Amino-5-methyl-2-propan-2-ylphenol.

Physical properties about Phenol, 4-amino-5-methyl-2-(1-methylethyl)- are: (1)ACD/LogP: 1.51; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.33; (4)ACD/LogD (pH 7.4): 1.51; (5)ACD/BCF (pH 5.5): 5.48; (6)ACD/BCF (pH 7.4): 8.24; (7)ACD/KOC (pH 5.5): 104.44; (8)ACD/KOC (pH 7.4): 157.19; (9)#H bond acceptors: 2; (10)#H bond donors: 3; (11)#Freely Rotating Bonds: 3; (12)Polar Surface Area: 12.47 Å2; (13)Index of Refraction: 1.57; (14)Molar Refractivity: 51.38 cm3; (15)Molar Volume: 156.4 cm3; (16)Surface Tension: 43 dyne/cm; (17)Density: 1.055 g/cm3; (18)Flash Point: 138 °C; (19)Enthalpy of Vaporization: 56.67 kJ/mol; (20)Boiling Point: 304.6 °C at 760 mmHg; (21)Vapour Pressure: 0.000481 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: Oc1cc(c(cc1C(C)C)N)C
(2) InChI: InChI=1/C10H15NO/c1-6(2)8-5-9(11)7(3)4-10(8)12/h4-6,12H,11H2,1-3H3
(3) InChIKey: RGRUKJFIPJHWNL-UHFFFAOYAI

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