Butyraldehyde - Distillation grade, ≥99.5% , CAS No.123-72-8

CAS: 123-72-8 Cat. No.: B100302 Formula: C₄H₈O Peso molecolare: 72.11 Beilstein Registry Number: 506061 Numero EC: 204-646-6

QUALITÀ & PUREZZA Distillation grade, ≥99.5%

Synonyms

butyraldehyde | butyr-aldehyde | Butalyde | Butyrylaldehyde | BUTYRALDEHYDE (USP-RS) | Pesticide Code: 202500 | Butyric aldehyde | 1-butanal | BUTYRALDEHYDE [HSDB] | 1-butanone | butanal | Butal | Butyraldehyde [UN1129] [Flammable liquid] | Butyraldehyde

Storage

Store at 2-8°C

Shipped In

Wet ice,FedEx DG Service

Specifiche

Sinonimi

butyraldehyde | butyr-aldehyde | Butalyde | Butyrylaldehyde | BUTYRALDEHYDE (USP-RS) | Pesticide Code: 202500 | Butyric aldehyde | 1-butanal | BUTYRALDEHYDE [HSDB] | 1-butanone | butanal | Butal | Butyraldehyde [UN1129] [Flammable liquid] | Butyraldehyde

Specifiche e purezza

Distillation grade, ≥99.5%

Condizioni di conservazione di stoccaggio

Store at 2-8°C

Spedito in

Wet ice,FedEx DG Service

Questo prodotto richiede spedizione a catena fredda. I servizi di terra e altri servizi economici non sono disponibili.

Grado

Distillation grade

Purezza

≥99.5%

Nomi e identificatori

Pubchem Sid

508813788

Sorrisi canonici

CCCC=O

IUPAC Name

butanal

InChIKey

ZTQSAGDEMFDKMZ-UHFFFAOYSA-N

INCHI

1S/C4H8O/c1-2-3-4-5/h4H,2-3H2,1H3

Isomeri SMILES

CCCC=O

WGK Germania

1

RTECS

ES2275000

Numero UN

1129

Gruppo di imballaggio

II

Peso molecolare

72.11

Beilstein

506061

Reaxy-Rn

506061

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=506061&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic oxygen compounds
    • Classe Organooxygen compounds
      • Subclass Carbonyl compounds
        • Level5 Aldehydes
          • Level6 Alpha-hydrogen aldehydes

• Kingdom: Organic compounds
• Superclass: Organic oxygen compounds
• Classe: Organooxygen compounds
• Subclass: Carbonyl compounds
• Intermediate Tree Nodes: Aldehydes
• Direct Parent: Alpha-hydrogen aldehydes
• Alternative Parents: Short-chain aldehydes Organic oxides Hydrocarbon derivatives
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Alpha-hydrogen aldehyde - Organic oxide - Hydrocarbon derivative - Short-chain aldehyde - Aliphatic acyclic compound
• Descrizione: This compound belongs to the class of organic compounds known as alpha-hydrogen aldehydes. These are aldehydes with the general formula HC(H)(R)C(=O)H, where R is an organyl group.
• External Descriptors: an n-alkanal

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

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Meccanismi d'azione

Proprietà chimiche e fisiche

• Punto di infiammabilità (°F): 23 °F
• Punto di infiammabilità (°C): -5 °C
• Punto di ebollizione (°C): 75°C
• Punto di fusione (°C): -96 °C
• Peso molecolare: 72.110 g/mol
• XLogP3: 0.900
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 2
• Exact Mass: 72.0575 Da
• Monoisotopic Mass: 72.0575 Da
• Topological Polar Surface Area: 17.100 Ų
• Heavy Atom Count: 5
• Formal Charge: 0
• Complexity: 24.800
• 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