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N-Methylisobutylamine

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Name

N-Methylisobutylamine

EINECS 210-893-0
CAS No. 625-43-4 Density 0.724 g/cm3
PSA 12.03000 LogP 1.25270
Solubility Miscible with water. Melting Point -75°C (estimate)
Formula C5H13N Boiling Point 73 °C at 760 mmHg
Molecular Weight 87.1649 Flash Point N/A
Transport Information N/A Appearance N/A
Safety 26-36/37/39 Risk Codes 11-34
Molecular Structure Molecular Structure of 625-43-4 (N-METHYLISOBUTYLAMINE) Hazard Symbols Xn
Synonyms

Propylamine,N,2-dimethyl- (7CI,8CI);2-Methyl-1-(methylamino)propane;Isobutylmethylamine;Methyl(2-methylpropyl)amine;Methylisobutylamine;N-Isobutyl-N-methylamine;N-Isobutylmethylamine;N-Methyl-2-methyl-n-propylamine;N-Methyl-2-methylpropan-1-amine;N-Methyl-N-isobutylamine;N-Methylisobutylamine;

Article Data 19

N-Methylisobutylamine Specification

The N-Methylisobutylamine with the cas number 625-43-4 is also called 1-Propanamine,N,2-dimethyl-. Both the systematic name and IUPAC name are  N,2-dimethylpropan-1-amine. Its EINECS registry number is 210-893-0. The molecular formula is C5H13N.

The properties of the chemical are: (1)ACD/LogP: 0.98; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -2.12; (4)ACD/LogD (pH 7.4): -1.93; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 1; (8)ACD/KOC (pH 7.4): 1; (9)#H bond acceptors: 1; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 3.24 Å2; (13)Index of Refraction: 1.393; (14)Molar Refractivity: 28.76 cm3; (15)Molar Volume: 120.2 cm3; (16)Polarizability: 11.4×10-24cm3; (17)Surface Tension: 20.6 dyne/cm; (18)Enthalpy of Vaporization: 31.43 kJ/mol; (19)Vapour Pressure: 116 mmHg at 25°C.

While using this chemical, you should be very cautious. This chemical is Highly flammable and can cause burns. Therefore, you should take the following instructions. Firstly, you should wear suitable protective clothing, gloves and eye/face protection. 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: N(CC(C)C)C
(2)InChI: InChI=1/C5H13N/c1-5(2)4-6-3/h5-6H,4H2,1-3H3
(3)InChIKey: QKYWADPCTHTJHQ-UHFFFAOYAG

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