1-Chloro-3-methoxypropane - ≥98% , CAS No.36215-07-3

CAS: 36215-07-3 Cat. No.: C108061 Summenformel: C₄H₉ClO Molekulargewicht: 108.57 Beilstein Registry Number: 1(4)1441 EG-Nummer: 252-919-3

GRADE & PURITY ≥98%

Synonyms

1-chlor-3-methoxypropane | methyl (3-chloropropyl) ether | SB36831 | 1-Chloro-3-methoxypropane | 1-chloro-3-methoxy-Propane | A823166 | Propane, 1-chloro-3-methoxy- | EINECS 252-919-3 | EN300-42679 | GS-3231 | methyl 3-chloropropyl ether | 3-Chloropropyl

Storage

Room temperature

Shipped In

Normal

Specifications

Synonyme

1-chlor-3-methoxypropane | methyl (3-chloropropyl) ether | SB36831 | 1-Chloro-3-methoxypropane | 1-chloro-3-methoxy-Propane | A823166 | Propane, 1-chloro-3-methoxy- | EINECS 252-919-3 | EN300-42679 | GS-3231 | methyl 3-chloropropyl ether | 3-Chloropropyl

Spezifikationen & Reinheit

≥98%

Storage

Room temperature

Verschickt in

Normal

Reinheit

≥98%

Namen und Kennungen

Pubchem Sid

488187595

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/488187595

Kanonisches Lächeln

COCCCCl

IUPAC Name

1-chloro-3-methoxypropane

InChIKey

BQLHMMQUVJCTAN-UHFFFAOYSA-N

INCHI

1S/C4H9ClO/c1-6-4-2-3-5/h2-4H2,1H3

Isomere SMILES

COCCCCl

UN-Nummer

1993

Verpackungsgruppe

III

Molekulargewicht

108.57

Beilstein

1(4)1441

Reaxy-Rn

1731202

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1731202&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic oxygen compounds
    • Klasse Organooxygen compounds
      • Subclass Ethers

• Kingdom: Organic compounds
• Superclass: Organic oxygen compounds
• Klasse: Organooxygen compounds
• Subclass: Ethers
• Intermediate Tree Nodes: Not available
• Direct Parent: Dialkyl ethers
• Alternative Parents: Organochlorides Hydrocarbon derivatives Alkyl chlorides
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Dialkyl ether - Hydrocarbon derivative - Organochloride - Organohalogen compound - Alkyl halide - Alkyl chloride - Aliphatic acyclic compound
• Beschreibung: This compound belongs to the class of organic compounds known as dialkyl ethers. These are organic compounds containing the dialkyl ether functional group, with the formula ROR', where R and R' are alkyl groups.
• External Descriptors: Not available

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

Chemische und physikalische Eigenschaften

• Brechungsindex: 1.41
• Flammpunkt (°C): 28 °C
• Siedepunkt (°C): 114°C
• Molekulargewicht: 108.570 g/mol
• XLogP3: 1.000
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 3
• Exact Mass: 108.034 Da
• Monoisotopic Mass: 108.034 Da
• Topological Polar Surface Area: 9.200 Ų
• Heavy Atom Count: 6
• Formal Charge: 0
• Complexity: 23.500
• 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