tert-Butyl 3-(methylamino)propylcarbamate supplier

Name
tert-Butyl 3-(methylamino)propylcarbamate
EINECS
CAS No. 442514-22-9
Article Data11
CAS DataBase
Density 0.95 g/cm³
Solubility
Melting Point
Formula C₉H₂₀N₂O₂
Boiling Point 280.3 °C at 760 mmHg
Molecular Weight 188.27
Flash Point 123.3 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms (3-Methylaminopropyl)carbamic acid tert-butyl ester;1-(tert-Butoxycarbonylamino)-3-methylaminopropane;
PSA 50.36000
LogP 1.90240

tert-Butyl 3-(methylamino)propylcarbamate Specification

The Carbamic acid,N-[3-(methylamino)propyl]-, 1,1-dimethylethyl ester with the CAS number 442514-22-9 is also called (3-Methylaminopropyl)carbamic acid tert-butyl ester. The systematic name is tert-butyl [3-(methylamino)propyl]carbamate. Its molecular formula is C₉H₂₀N₂O₂. This chemical is a kind of organics. It should be stored in dry and cool environment.

The properties of the Carbamic acid,N-[3-(methylamino)propyl]-, 1,1-dimethylethyl ester are: (1)ACD/LogP: 0.99; (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: 4; (8)#H bond donors: 2; (9)#Freely Rotating Bonds: 6; (10)Polar Surface Area: 32.78Å²; (11)Index of Refraction: 1.444; (12)Molar Refractivity: 52.67 cm³; (13)Molar Volume: 198.2 cm³; (14)Polarizability: 20.88×10^-24cm³; (15)Surface Tension: 30.5 dyne/cm; (16)Enthalpy of Vaporization: 51.9 kJ/mol; (17)Vapour Pressure: 0.00381 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C(OC(C)(C)C)NCCCNC
(2)InChI: InChI=1/C9H20N2O2/c1-9(2,3)13-8(12)11-7-5-6-10-4/h10H,5-7H2,1-4H3,(H,11,12)
(3)InChIKey: YIMSPDZAVBIXRT-UHFFFAOYAR

Product Name

tert-Butyl 3-(methylamino)propylcarbamate

tert-Butyl 3-(methylamino)propylcarbamate Specification

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