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1-Propanamine,N-(1-methylethyl)-

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Name

1-Propanamine,N-(1-methylethyl)-

EINECS 244-688-2
CAS No. 21968-17-2 Density 0.739 g/cm3
Solubility Melting Point
Formula C6H15N Boiling Point 102.9 °C at 760 mmHg
Molecular Weight 101.19 Flash Point 1.1 °C
Transport Information Appearance
Safety Risk Codes
Molecular Structure Molecular Structure of 21968-17-2 (1-Propanamine,N-(1-methylethyl)-) Hazard Symbols CorrosiveC
Synonyms

N-Isopropylpropan-1-amine;N-(Propan-2-yl)propan-1-amine;N-Propyl-N-isopropylamine;N-(1-Methylethyl)-1-propanamine;N-Isopropylpropylamine;

 

1-Propanamine,N-(1-methylethyl)- Specification

The 1-Propanamine,N-(1-methylethyl)-, with the CAS registry number 21968-17-2, is also known as N-Isopropylpropan-1-amine. Its EINECS number is 244-688-2. The molecular formula of this chemical is C6H15N and molecular weight is 101.19. What's more, its systematic name is N-(Propan-2-yl)propan-1-amine. The product will not decompose, if it is used and stored according to the regulations. It should be protected from oxides and be sealed and stored in containers which are placed in cool, dry places.

Physical properties of 1-Propanamine,N-(1-methylethyl)- are: (1)ACD/LogP: 1.51; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -1.59; (4)ACD/LogD (pH 7.4): -1.4; (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: 3; (12)Polar Surface Area: 3.24 Å2; (13)Index of Refraction: 1.403; (14)Molar Refractivity: 33.39 cm3; (15)Molar Volume: 136.7 cm3; (16)Polarizability: 13.24×10-24 cm3; (17)Surface Tension: 22 dyne/cm; (18)Density: 0.739 g/cm3; (19)Flash Point: 1.1 °C; (20)Enthalpy of Vaporization: 32.14 kJ/mol; (21)Boiling Point: 102.9 °C at 760 mmHg; (22)Vapour Pressure: 32.9 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1)Canonical SMILES: CCCNC(C)C
(2)InChI: InChI=1S/C6H15N/c1-4-5-7-6(2)3/h6-7H,4-5H2,1-3H3
(3)InChIKey: VLSTXUUYLIALPB-UHFFFAOYSA-N

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