Methanediamine,N,N'...

Methanediamine,N,N'-dibutyl-N,N'-di-2-cyclopenten-1-yl-(CAS No. 5462-23-7)

Methanediamine,N,N'-dibutyl-N,N'-di-2-cyclopenten-1-yl-(CAS No. 5462-23-7)

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Methanediamine,N,N'-dibutyl-N,N'-di-2-cyclopenten-1-yl- 5462-23-7 98%

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  • Appearance:Solid
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Details:

【Name】
Methanediamine,N,N'-dibutyl-N,N'-di-2-cyclopenten-1-yl-
【Iupac name】
N,N'-dibutyl-N,N'-di(cyclopent-2-en-1-yl)methanediamine
【CAS Registry number】
5462-23-7
【Synonyms】
NSC 7186
【Molecular Formula】
C19H34 N2 (Products with the same molecular formula)
【Molecular Weight】
290.4867
【Inchi】
InChI=1/C19H34N2/c1-3-5-15-20(18-11-7-8-12-18)17-21(16-6-4-2)19-13-9-10-14-19/h7,9,11,13,18-19H,3-6,8,10,12,14-17H2,1-2H3
【Canonical SMILES】
CCCCN(CN(CCCC)C1CCC=C1)C2CCC=C2
Chemical and Physical Properties
【Density】
0.95g/cm3
【Boiling Point】
379.3°Cat760mmHg
【Refractive Index】
1.526
【Flash Point】
164.5°C
【Computed Properties】
Molecular Weight:290.48666 [g/mol]
Molecular Formula:C19H34N2
XLogP3-AA:5.1
H-Bond Donor:0
H-Bond Acceptor:2
Rotatable Bond Count:10
Exact Mass:290.272199
MonoIsotopic Mass:290.272199
Topological Polar Surface Area:6.5
Heavy Atom Count:21
Formal Charge:0
Complexity:303
Isotope Atom Count:0
Defined Atom Stereocenter Count:0
Undefined Atom Stereocenter Count:2
Defined Bond Stereocenter Count:0
Undefined Bond Stereocenter Count:0
Covalently-Bonded Unit Count:1
Feature 3D Cation Count:2
Feature 3D Hydrophobe Count:2
Feature 3D Ring Count:2
Effective Rotor Count:11.2
Conformer Sampling RMSD:1.2
CID Conformer Count:36

 

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