GRADE & PURITY ≥98%(GC)

Synonyms

A,5 | A,3 | SCHEMBL2024288 | 1,3,5-Cyclohexanetricarbonitrile | D89471 | BS-43934 | AKOS015914344 | 1,3,5-CYCLOHEXANETRICARBONITRILE, (1ALPHA,3ALPHA,5ALPHA)- | A)-Cyclohexane-1,3,5-tricarbonitrile | (1 | C2327 | (1alpha,3alpha,5alpha)-1,3,5-Cyclohexanetri

Storage

Room temperature

Shipped In

Normal

Specifications

Sinónimos

A, 5 | A, 3 | SCHEMBL2024288 | 1, 3, 5-Cyclohexanetricarbonitrile | D89471 | BS-43934 | AKOS015914344 | 1, 3, 5-CYCLOHEXANETRICARBONITRILE, (1ALPHA, 3ALPHA, 5ALPHA)- | A)-Cyclohexane-1, 3, 5-tricarbonitrile | (1 | C2327 | (1alpha, 3alpha, 5alpha)-1, 3, 5-Cyclohexanetri

Especificaciones y pureza

≥98%(GC)

Condiciones de almacenamiento de almacenamiento

Room temperature

Enviado en

Normal

Pureza

≥98%(GC)

Nombres e identificadores

• Sonrisas canónicas: C1C(CC(CC1C#N)C#N)C#N
• IUPAC Name: cyclohexane-1,3,5-tricarbonitrile
• InChIKey: VMUOSHREZKXCIV-UHFFFAOYSA-N
• INCHI: 1S/C9H9N3/c10-4-7-1-8(5-11)3-9(2-7)6-12/h7-9H,1-3H2
• Isómeros SMILES: C1C(CC(CC1C#N)C#N)C#N
• Peso molecular: 159.19
• Reaxy-Rn: 2830394
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2830394&ln=

Propiedades químicas y físicas

• Punto de ebullición (°C): 200°C/0.2mmHg(lit.)
• Peso molecular: 159.190 g/mol
• XLogP3: 0.200
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 0
• Exact Mass: 159.08 Da
• Monoisotopic Mass: 159.08 Da
• Topological Polar Surface Area: 71.400 Ų
• Heavy Atom Count: 12
• Formal Charge: 0
• Complexity: 240.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 0
• Undefined Atom Stereocenter Count: 0
• Defined Bond Stereocenter Count: 0
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 0
• Covalently-Bonded Unit Count: 1