CAS No.13987-61-6,TERT-BUTYLAZOMETHINE Suppliers

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Basic Information

Molecular Structure:
CAS No.:	13987-61-6
Name:	TERT-BUTYLAZOMETHINE
Article Data:	24

Formula:	C₅H₁₁N
Molecular Weight:	85.149
Synonyms:	Ethylamine,1,1-dimethyl-N-methylene- (6CI,7CI,8CI);N-Methylene-tert-butylamine;N-Methylidene-tert-butylamine;N-tert-Butylazomethine;tert-Butylazomethine;tert-Butylformaldimine;tert-Butylmethyleneamine;
EINECS:	237-781-4
Density:	0.71 g/cm³
Boiling Point:	87.1 °C at 760 mmHg
Flash Point:	-3℃
PSA:	12.36000
LogP:	1.48550

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Specification

The 2-Propanamine,2-methyl-N-methylene-, with the CAS registry number 13987-61-6 and EINECS registry number 237-781-4, has the systematic name of 2-methyl-N-methylidenepropan-2-amine. It is a kind of organics, and should be stored at dry and cool environment. And the molecular formula of this chemical is C₅H₁₁N.

The physical properties of 2-Propanamine,2-methyl-N-methylene- are as followings: (1)ACD/LogP: 2.17; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 0.64; (4)ACD/LogD (pH 7.4): 1.96; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 16.28; (7)ACD/KOC (pH 5.5): 10.64; (8)ACD/KOC (pH 7.4): 223.49; (9)#H bond acceptors: 1; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 12.36 Å²; (13)Index of Refraction: 1.393; (14)Molar Refractivity: 28.42 cm³; (15)Molar Volume: 118.9 cm³; (16)Polarizability: 11.27×10^-24cm³; (17)Surface Tension: 20.1 dyne/cm; (18)Density: 0.71 g/cm³; (19)Enthalpy of Vaporization: 31.37 kJ/mol; (20)Boiling Point: 87.1 °C at 760 mmHg; (21)Vapour Pressure: 72.7 mmHg at 25°C.

Preparation of 2-Propanamine,2-methyl-N-methylene-: This chemical can be prepared by tert-butylamine and formaldehyde. The reaction will need the solvent H₂O. The reaction time is 0.5 hours with temperature of 40°C, and the yield is about 92%.

2-Propanamine,2-methyl-N-methylene can be prepared by tert-butylamine and formaldehyde

Uses of 2-Propanamine,2-methyl-N-methylene-: It can react with acetamide to produce N-{[(acetylamino-methyl)-tert-butyl-amino]-methyl}-acetamide. The reaction time is 3 hours with heating, and the yield is about 94%.

2-Propanamine,2-methyl-N-methylene- can react with acetamide to produce N-{[(acetylamino-methyl)-tert-butyl-amino]-methyl}-acetamide

You can still convert the following datas into molecular structure:
(1)SMILES: N(=C)\C(C)(C)C
(2)InChI: InChI=1/C5H11N/c1-5(2,3)6-4/h4H2,1-3H3
(3)InChIKey: RSUCYDXEFFBUSN-UHFFFAOYAE

The toxicity data is as follows:

Organism	Test Type	Route	Reported Dose (Normalized Dose)	Effect	Source
rat	LCLo	inhalation	1610mg/m³/4H (1610mg/m³)	LUNGS, THORAX, OR RESPIRATION: ACUTE PULMONARY EDEMA LUNGS, THORAX, OR RESPIRATION: DYSPNEA	National Technical Information Service. Vol. OTS0533856,