(R)-4-(3-Amino-butyl)-phenol supplier

Name
(R)-4-(3-Amino-butyl)-phenol
EINECS
CAS No. 115548-15-7
Article Data7
CAS DataBase
Density 1.047 g/cm³
Solubility
Melting Point
Formula C₁₀H₁₅NO
Boiling Point 295.3 °C at 760 mmHg
Molecular Weight 165.235
Flash Point 132.4 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms (R)-4-(3-Aminobutyl)phenol;
PSA 46.25000
LogP 2.37230

(R)-4-(3-Amino-butyl)-phenol Specification

The (R)-4-(3-Amino-butyl)-phenol, with the CAS registry number 115548-15-7, is also known as (R)-4-(3-Aminobutyl)phenol. It belongs to the product category of Pharmacetical. This chemical's molecular formula is C₁₀H₁₅NO and molecular weight is 165.2322. What's more, its systematic name is 4-[(3R)-3-Aminobutyl]phenol.

Physical properties about (R)-4-(3-Amino-butyl)-phenol are: (1)ACD/LogP: 1.44; (2)# of Rule of 5 Violations: 0; (3)ACD/BCF (pH 5.5): 1; (4)ACD/BCF (pH 7.4): 1; (5)ACD/KOC (pH 5.5): 1; (6)ACD/KOC (pH 7.4): 1; (7)#H bond acceptors: 2; (8)#H bond donors: 3; (9)#Freely Rotating Bonds: 5; (10)Polar Surface Area: 46.25 Å²; (11)Index of Refraction: 1.552; (12)Molar Refractivity: 50.44 cm³; (13)Molar Volume: 157.7 cm³; (14)Polarizability: 19.99×10^-24 cm³; (15)Surface Tension: 43.3 dyne/cm; (16)Density: 1.047 g/cm³; (17)Flash Point: 132.4 °C; (18)Enthalpy of Vaporization: 55.64 kJ/mol; (19)Boiling Point: 295.3 °C at 760 mmHg; (20)Vapour Pressure: 0.000874 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: Oc1ccc(CC[C@@H](C)N)cc1
(2) InChI: InChI=1/C10H15NO/c1-8(11)2-3-9-4-6-10(12)7-5-9/h4-8,12H,2-3,11H2,1H3/t8-/m1/s1
(3) InChIKey: WNTVTQIJPAFZEL-MRVPVSSYBR

Product Name

(R)-4-(3-Amino-butyl)-phenol

(R)-4-(3-Amino-butyl)-phenol Specification

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