Amyl Nitrite - ≥95%(GC) , CAS No.463-04-7

CAS: 463-04-7 Cat. No.: A151126 Formule: C₅H₁₁NO₂ Poids moléculaire: 117.15 Beilstein Registry Number: 1(4)1644 Numéro CE: 207-332-7

QUALITÉ & PURETÉ ≥95%(GC)

Synonyms

CHEBI:55344 | Pentylnitrite | AKOS015853631 | BRN 1701241 | Pentyl alcohol, nitrite | Pentyl nitrite, AldrichCPR | HSDB 8468 | n-pentylnitrite | Z1255461260 | AMY3989 | FT-0622367 | Pentyl nitrite | CCRIS 763 | CAS-463-04-7 | A802198 | DTXCID804522 | NITR

Storage

Store at 2-8°C,Argon charged

Shipped In

Wet ice,FedEx DG Service

Spécifications

Synonymes

CHEBI:55344 | Pentylnitrite | AKOS015853631 | BRN 1701241 | Pentyl alcohol, nitrite | Pentyl nitrite, AldrichCPR | HSDB 8468 | n-pentylnitrite | Z1255461260 | AMY3989 | FT-0622367 | Pentyl nitrite | CCRIS 763 | CAS-463-04-7 | A802198 | DTXCID804522 | NITR

Spécifications et pureté

≥95%(GC)

Conditions de stockage de stockage

Store at 2-8°C,Argon charged

Expédié en

Wet ice,FedEx DG Service

Ce produit nécessite l'expédition en chaîne froide. Les services terrestres et autres services économiques ne sont pas disponibles.

Pureté

≥95%(GC)

Noms et identifiants

Pubchem Sid

488181078

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/488181078

Sourires canoniques

CCCCCON=O

IUPAC Name

pentyl nitrite

InChIKey

CSDTZUBPSYWZDX-UHFFFAOYSA-N

INCHI

1S/C5H11NO2/c1-2-3-4-5-8-6-7/h2-5H2,1H3

Isomères SMILES

CCCCCON=O

RTECS

RA1140000

Numéro ONU

1113

Groupe d'emballage

II

Poids moléculaire

117.15

Beilstein

1(4)1644

Reaxy-Rn

1701241

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1701241&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic nitrogen compounds
    • Classe Organonitrogen compounds
      • Subclass Organic nitroso compounds

• Kingdom: Organic compounds
• Superclass: Organic nitrogen compounds
• Classe: Organonitrogen compounds
• Subclass: Organic nitroso compounds
• Intermediate Tree Nodes: Not available
• Direct Parent: Organic O-nitroso compounds
• Alternative Parents: Alkyl nitrites Organooxygen compounds Organic oxides Hydrocarbon derivatives
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Organic o-nitroso compound - Alkyl nitrite - Organic nitrite - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Aliphatic acyclic compound
• Description: This compound belongs to the class of organic compounds known as organic o-nitroso compounds. These are organic compounds containing a n-nitroso group -ON=O.
• External Descriptors: nitrite esters

Data sources

1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61.

DOI: 10.1186/s13321-016-0174-y

Propriétés chimiques et physiques

• Solubilité: Solubility in water: Decomposes in contact with water,Practically insoluble; Miscible with Chloroform,Ether,Ethanol
• Sensibilité: Heat & Light & Air Sensitive
• Indice de réfraction: 1.39
• Point d'éclair (°F): -18°C(lit.)
• Point d'éclair (°C): -18°C(lit.)
• Point d'ébullition (°C): 104 °C
• Poids moléculaire: 117.150 g/mol
• XLogP3: 1.800
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 4
• Exact Mass: 117.079 Da
• Monoisotopic Mass: 117.079 Da
• Topological Polar Surface Area: 38.700 Ų
• Heavy Atom Count: 8
• Formal Charge: 0
• Complexity: 56.400
• 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