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1,1-Dibutoxytrimethylamine

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Name

1,1-Dibutoxytrimethylamine

EINECS 242-387-0
CAS No. 18503-90-7 Density 0.853
PSA 21.70000 LogP 2.46500
Solubility N/A Melting Point N/A
Formula C11H25NO2 Boiling Point 232.5 °C at 760 mmHg
Molecular Weight 203.325 Flash Point 53 ºC
Transport Information UN 1993 Appearance clear brown
Safety 26-36 Risk Codes R10;R36/37/38   
Molecular Structure Molecular Structure of 18503-90-7 (1,1-Dibutoxytrimethylamine) Hazard Symbols
Synonyms

Trimethylamine,1,1-dibutoxy- (6CI,8CI);DMF-dibutyl acetal;Dimethylformamide dibutyl acetal;Formamide, N,N-dimethyl-, dibutyl acetal;N,N-Dimethylformamide dibutyl acetal;

Article Data 4

1,1-Dibutoxytrimethylamine Specification

The 1,1-Dibutoxytrimethylamine, with the cas registry number 18503-90-7, has the systematic name of 1,1-dibutoxy-N,N-dimethylmethanamine. Its product categories are various, including Analytical Chemistry; Esterification & Alkylation (GC Derivatizing Reagents); GC Derivatizing Reagents; N,N-Dimethylformamide Dialkylacetals (GC Derivatizing Reagents). The molecular formula of the chemical is C11H25NO2.

The characteristics of this chemical are as followings: (1)ACD/LogP: 3.94; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 3.75; (4)ACD/LogD (pH 7.4): 3.93; (5)ACD/BCF (pH 5.5): 378.43; (6)ACD/BCF (pH 7.4): 572.31; (7)ACD/KOC (pH 5.5): 2163; (8)ACD/KOC (pH 7.4): 3271.19; (9)#H bond acceptors: 3; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 9; (12)Polar Surface Area: 21.7 Å2; (13)Index of Refraction: 1.435; (14)Molar Refractivity: 60.18 cm3; (15)Molar Volume: 230.4 cm3; (16)Polarizability: 23.85×10-24cm3; (17)Surface Tension: 28.4 dyne/cm; (18)Density: 0.882 g/cm3; (19)Flash Point: 52.2 °C; (20)Enthalpy of Vaporization: 46.92 kJ/mol; (21)Boiling Point: 232.5 °C at 760 mmHg; (22)Vapour Pressure: 0.0589 mmHg at 25°C.

You should be cautious while dealing with this chemical. It is a kind of flammable chemical and it irritates to eyes, respiratory system and skin. Therefore, you had better take the following instructions: Wear suitable cloting, and if in case of contacting with eyes, rinse immediately with plenty of water and seek medical advice.

Addtionally, the following datas could be converted into the molecular structure:
(1)SMILES: O(CCCC)C(OCCCC)N(C)C
(2)InChI: InInChI=1/C11H25NO2/c1-5-7-9-13-11(12(3)4)14-10-8-6-2/h11H,5-10H2,1-4H3
(3)InChIKey: GSFFXKGTGPMVLM-UHFFFAOYAK

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