Tetrahydro-2H-pyran-3-amine supplier

Name
2H-PYRAN-3-AMINE, TETRAHYDRO-
EINECS
CAS No. 120811-32-7
Article Data1
CAS DataBase
Density 0.963 g/cm³
Solubility
Melting Point
Formula C₅H₁₁NO
Boiling Point 151.357 °C at 760 mmHg
Molecular Weight 101.148
Flash Point 49.266 °C
Transport Information
Appearance
Safety 26-39
Risk Codes Xi:;
Molecular Structure
Hazard Symbols Xi
Synonyms (Tetrahydro-2H-pyran-3-yl)amine;3-Aminotetrahydropyran;
PSA 35.25000
LogP 0.82440

Tetrahydro-2H-pyran-3-amine Specification

The 2H-Pyran-3-amine,tetrahydro-, with the CAS registry number 120811-32-7, has the systematic name and IUPAC name of tetrahydro-2H-pyran-3-amine. It is a kind of irritant chemical, and the molecular formula of the chemical is C₅H₁₁NO.

The characteristics of 2H-Pyran-3-amine,tetrahydro- are as followings: (1)ACD/LogP: -0.46; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -3.54; (4)ACD/LogD (pH 7.4): -2.91; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 1; (8)ACD/KOC (pH 7.4): 1; (9)#H bond acceptors: 2; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 12.47 Å²; (13)Index of Refraction: 1.449; (14)Molar Refractivity: 28.21 cm³; (15)Molar Volume: 105 cm³; (16)Polarizability: 11.18×10^-24cm³; (17)Surface Tension: 34.5 dyne/cm; (18)Density: 0.962 g/cm³; (19)Flash Point: 49.3 °C; (20)Enthalpy of Vaporization: 38.82 kJ/mol; (21)Boiling Point: 151.4 °C at 760 mmHg; (22)Vapour Pressure: 3.68 mmHg at 25°C.

Addtionally, the following datas could be converted into the molecular structure:
(1)SMILES: O1CCCC(N)C1
(2)InChI: InChI=1/C5H11NO/c6-5-2-1-3-7-4-5/h5H,1-4,6H2
(3)InChIKey: WUUOEJJGRCQGBQ-UHFFFAOYAN

Product Name

2H-PYRAN-3-AMINE, TETRAHYDRO-

Tetrahydro-2H-pyran-3-amine Specification

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