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93804-36-5

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Basic Information
CAS No.: 93804-36-5
Name: N-[3-(dimethylamino)propyl]-N'-[3-[[3-(dimethylamino)propyl]amino]propyl]propane-1,3-diamine
Molecular Structure:
Molecular Structure of 93804-36-5 (N-[3-(dimethylamino)propyl]-N'-[3-[[3-(dimethylamino)propyl]amino]propyl]propane-1,3-diamine)
Formula: C16H39N5
Molecular Weight: 301.51436
Synonyms: 1,3-Propanediamine,N-[3-(dimethylamino)propyl]-N'-[3-[[3-(dimethylamino)propyl]amino]propyl]-(9CI);
EINECS: 298-412-0
Density: 0.903 g/cm3
Boiling Point: 394.9 °C at 760 mmHg
Flash Point: 176.9 °C
PSA: 42.57000
LogP: 1.61150
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  • N-[3-(dimethylamino)propyl]-N'-[3-[[3-(dimethylamino)propyl]amino]propyl]propane-1,3-diamine

  • Casno:

    93804-36-5

    N-[3-(dimethylamino)propyl]-N'-[3-[[3-(dimethylamino)propyl]amino]propyl]propane-1,3-diamine

    Min.Order: 1 Kilogram

    FOB Price:  USD $ 2.0-2.0

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Specification

The 1,3-Propanediamine,N1-[3-(dimethylamino)propyl]-N3-[3-[[3-(dimethylamino)propyl]amino]propyl]-, with the CAS registry number 93804-36-5, is also known as N-(3-(Dimethylamino)propyl)-N'-(3-((3-(dimethylamino)propyl)amino)propyl)propane-1,3-diamine. Its EINECS registry number is 298-412-0. This chemical's molecular formula is C16H39N5 and molecular weight is 301.51436. Its IUPAC name is called N'-[3-(dimethylamino)propyl]-N-[3-[3-(dimethylamino)propylamino]propyl]propane-1,3-diamine.

Physical properties of 1,3-Propanediamine,N1-[3-(dimethylamino)propyl]-N3-[3-[[3-(dimethylamino)propyl]amino]propyl]-: (1)ACD/LogP: 0.07; (2)ACD/LogD (pH 5.5): -7.02; (3)ACD/LogD (pH 7.4): -6.52; (4)ACD/BCF (pH 5.5): 1; (5)ACD/BCF (pH 7.4): 1; (6)ACD/KOC (pH 5.5): 1; (7)ACD/KOC (pH 7.4): 1; (8)#H bond acceptors: 5; (9)#H bond donors: 3; (10)#Freely Rotating Bonds: 16; (11)Index of Refraction: 1.477; (12)Molar Refractivity: 94.4 cm3; (13)Molar Volume: 333.5 cm3; (14)Surface Tension: 33.7 dyne/cm; (15)Density: 0.903 g/cm3; (16)Flash Point: 176.9 °C; (17)Enthalpy of Vaporization: 64.5 kJ/mol; (18)Boiling Point: 394.9 °C at 760 mmHg; (19)Vapour Pressure: 1.91E-06 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)Canonical SMILES: CN(C)CCCNCCCNCCCNCCCN(C)C
(2)InChI: InChI=1S/C16H39N5/c1-20(2)15-7-13-18-11-5-9-17-10-6-12-19-14-8-16-21(3)4/h17-19H,5-16H2,1-4H3
(3)InChIKey: JSLHZPPSKXAHBR-UHFFFAOYSA-N