Butyl-N-tert-butyl carbamate supplier

Name
Butyl-N-tert-butyl carbamate
EINECS
CAS No. 22815-64-1
Article Data3
CAS DataBase
Density 0.914 g/cm³
Solubility
Melting Point
Formula C₉H₁₉NO₂
Boiling Point 217.8 °C at 760 mmHg
Molecular Weight 173.255
Flash Point 85.5 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms Butyl tert-butylcarbamate;Butyl N-tert-butylcarbamate;
PSA 38.33000
LogP 2.70210

Butyl-N-tert-butyl carbamate Specification

The Butyl-N-tert-butyl carbamate has CAS registry number 22815-64-1. It is also named as Butyl tert-butylcarbamate. The molecular formula of this chemical is C₉H₁₉NO₂ and its molecular weight is 173.25266. What's more, its IUPAC name is Butyl N-tert-butylcarbamate.

Physical properties about Butyl-N-tert-butyl carbamate are: (1)ACD/LogP: 2.71; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.71; (4)ACD/LogD (pH 7.4): 2.71; (5)ACD/BCF (pH 5.5): 67.5; (6)ACD/BCF (pH 7.4): 67.5; (7)ACD/KOC (pH 5.5): 709.61; (8)ACD/KOC (pH 7.4): 709.61; (9)#H bond acceptors: 3; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 5; (12)Polar Surface Area: 29.54 Å²; (13)Index of Refraction: 1.431; (14)Molar Refractivity: 49.08 cm³; (15)Molar Volume: 189.4 cm³; (16)Polarizability: 19.45×10^-24 cm³; (17)Surface Tension: 28.5 dyne/cm; (18)Density: 0.914 g/cm³; (19)Flash Point: 85.5 °C; (20)Enthalpy of Vaporization: 45.42 kJ/mol; (21)Boiling Point: 217.8 °C at 760 mmHg; (22)Vapour Pressure: 0.13 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: O=C(OCCCC)NC(C)(C)C
(2) InChI: InChI=1/C9H19NO2/c1-5-6-7-12-8(11)10-9(2,3)4/h5-7H2,1-4H3,(H,10,11)
(3) InChIKey: LQELBWUBHZPYML-UHFFFAOYAV

Product Name

Butyl-N-tert-butyl carbamate

Butyl-N-tert-butyl carbamate Specification

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