1-Pentene, 4,4-dini...

1-Pentene, 4,4-dinitro- 5432-39-3

1-Pentene, 4,4-dinitro- 5432-39-3

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1-Pentene, 4,4-dinitro- 5432-39-3 C5H8 N2 O4

Quick Details

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

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Our company was built in 2009 with an ISO certificate.In the past 5 years, we have grown up as a famous fine chemicals supplier in China and we had established stable business relationships with Samsung,LG,Merck,Thermo Fisher Scientific and so on.Our main business covers the fields below:
 
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Details:

【Name】
1-Pentene, 4,4-dinitro-
【CAS Registry number】
5432-39-3
【Synonyms】
4,4-Dinitro-1-pentene
NSC 16176
【Molecular Formula】
C5H8 N2 O4 (Products with the same molecular formula)
【Molecular Weight】
160.128
【Inchi】
InChI=1/C5H8N2O4/c1-3-4-5(2,6(8)9)7(10)11/h3H,1,4H2,2H3
【Canonical SMILES】
CC(CC=C)([N+](=O)[O-])[N+](=O)[O-]
Chemical and Physical Properties
【Density】
1.215g/cm3
【Boiling Point】
202.2°Cat760mmHg
【Refractive Index】
1.472
【Flash Point】
75.3°C
【Computed Properties】
Molecular Weight:160.12802 [g/mol]
Molecular Formula:C5H8N2O4
XLogP3-AA:1.4
H-Bond Donor:0
H-Bond Acceptor:4
Rotatable Bond Count:2
Exact Mass:160.048407
MonoIsotopic Mass:160.048407
Topological Polar Surface Area:91.6
Heavy Atom Count:11
Formal Charge:0
Complexity:176
Isotope Atom Count:0
Defined Atom Stereocenter Count:0
Undefined Atom Stereocenter Count:0
Defined Bond Stereocenter Count:0
Undefined Bond Stereocenter Count:0
Covalently-Bonded Unit Count:1
Feature 3D Acceptor Count:4
Feature 3D Anion Count:2
Feature 3D Hydrophobe Count:1
Effective Rotor Count:4
Conformer Sampling RMSD:0.6
CID Conformer Count:24

 

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