N-(1-phenylethyl)et...

N-(1-phenylethyl)ethane-1,2-diamine 5424-17-9

N-(1-phenylethyl)ethane-1,2-diamine 5424-17-9

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  • Purity: 99%
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N-(1-phenylethyl)ethane-1,2-diamine 5424-17-9 98%

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  • Appearance:Solid
  • Application:Organic Chemicals
  • PackAge:as requested
  • ProductionCapacity:100|Kilogram|Month
  • Storage:Room Temperature
  • Transportation:as requested

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Details:

【Name】
N-(1-phenylethyl)ethane-1,2-diamine
【Iupac name】
N'-(1-phenylethyl)ethane-1,2-diamine
【CAS Registry number】
5424-17-9
【Synonyms】
N-(.alpha.-Methylbenzyl)-ethylenediamine
N-(alpha-Methylbenzyl)ethylenediamine
【Molecular Formula】
C10H16N2 (Products with the same molecular formula)
【Molecular Weight】
164.2474
【Inchi】
InChI=1/C10H16N2/c1-9(12-8-7-11)10-5-3-2-4-6-10/h2-6,9,12H,7-8,11H2,1H3
【Canonical SMILES】
CC(C1=CC=CC=C1)NCCN
【MOL File】
5424-17-9.mol
Chemical and Physical Properties
【Density】
0.974g/cm3
【Boiling Point】
263.6°C at 760 mmHg
【Refractive Index】
1.531
【Flash Point】
130.6°C
【Computed Properties】
Molecular Weight:164.24744 [g/mol]
Molecular Formula:C10H16N2
XLogP3-AA:0.8
H-Bond Donor:2
H-Bond Acceptor:2
Rotatable Bond Count:4
Exact Mass:164.131349
MonoIsotopic Mass:164.131349
Topological Polar Surface Area:38
Heavy Atom Count:12
Formal Charge:0
Complexity:108
Isotope Atom Count:0
Defined Atom Stereocenter Count:0
Undefined Atom Stereocenter Count:1
Defined Bond Stereocenter Count:0
Undefined Bond Stereocenter Count:0
Covalently-Bonded Unit Count:1
Feature 3D Donor Count:2
Feature 3D Cation Count:2
Feature 3D Ring Count:1
Effective Rotor Count:4
Conformer Sampling RMSD:0.6
CID Conformer Count:16

 

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