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1,1-Di-tert-butoxytrimethylamine

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Name

1,1-Di-tert-butoxytrimethylamine

EINECS 253-222-7
CAS No. 36805-97-7 Density 0.882 g/cm3
PSA 21.70000 LogP 2.46180
Solubility N/A Melting Point N/A
Formula C11H25NO2 Boiling Point 175.2 °C at 760 mmHg
Molecular Weight 203.325 Flash Point 33.9 °C
Transport Information UN 1993 3/PG 3 Appearance N/A
Safety 26-36 Risk Codes 10-36/37/38
Molecular Structure Molecular Structure of 36805-97-7 (1,1-Di-tert-butoxytrimethylamine) Hazard Symbols IrritantXi
Synonyms

Trimethylamine,1,1-di-tert-butoxy- (7CI);1,1-Di-tert-butoxy-N,N-dimethylmethaneamine;DMFdi-tert-butyl acetal;Di-tert-butoxymethyldimethylamine;Di-tert-butyldimethylformamide acetal;Dimethylformamide di-tert-butyl acetal;N,N-DMFdi-tert-butyl acetal;N,N-Dimethylformamide di-tert-butyl acetal;

Article Data 9

1,1-Di-tert-butoxytrimethylamine Specification

The 1,1-Di-tert-butoxytrimethylamine with the cas number 36805-97-7 is also called Methanamine,1,1-bis(1,1-dimethylethoxy)-N,N-dimethyl-. The IUPAC name is N,N-dimethyl-1,1-bis[(2-methylpropan-2-yl)oxy]methanamine. Its EINECS registry number is 253-222-7. The molecular formula is C11H25NO2. This chemical belongs to the following product categories: (1)Analytical Chemistry; (2)Esterification & Alkylation (GC Derivatizing Reagents); (3)GC Derivatizing Reagents; (4)N,N-Dimethylformamide Dialkylacetals (GC Derivatizing Reagents).

The properties of the chemical are: (1)ACD/LogP: 3.20; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.98; (4)ACD/LogD (pH 7.4): 3.2; (5)ACD/BCF (pH 5.5): 95.09; (6)ACD/BCF (pH 7.4): 158.76; (7)ACD/KOC (pH 5.5): 782.09; (8)ACD/KOC (pH 7.4): 1305.68; (9)#H bond acceptors: 3; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 5; (12)Polar Surface Area: 21.7 Å2; (13)Index of Refraction: 1.434; (14)Molar Refractivity: 60.11 cm3; (15)Molar Volume: 230.5 cm3; (16)Polarizability: 23.83×10-24cm3; (17)Surface Tension: 26.3 dyne/cm; (18)Enthalpy of Vaporization: 41.15 kJ/mol; (19)Vapour Pressure: 1.16 mmHg at 25°C.

While using this chemical, you should be very cautious. This chemical is flammable. It is not only irritating to skin, but also irritating to eyes and respiratory system. Therefore, you should take the following instructions. Firstly, you should wear suitable protective clothing. Then in case of contact with eyes, you should rinse immediately with plenty of water and seek medical advice.

You can still convert the following datas into molecular structure:
(1)SMILES: O(C(C)(C)C)C(OC(C)(C)C)N(C)C
(2)InChI: InChI=1/C11H25NO2/c1-10(2,3)13-9(12(7)8)14-11(4,5)6/h9H,1-8H3
(3)InChIKey: DBNQIOANXZVWIP-UHFFFAOYAP

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