2-クロロ-5-(シクロプロピルメトキシ)ピリミジン - ≥97% , CAS No.169677-66-1

CAS: 169677-66-1 Cat. No.: C191470 分子式: C₈H₉ClN₂O 分子量: 184.62

GRADE & PURITY ≥97%

Synonyms

FT-0704938 | EN300-7390514 | A882079 | ILLJCQSVKGFRHZ-UHFFFAOYSA-N | SB57300 | SCHEMBL1697756 | AKOS016013061 | DTXSID50702688 | DS-14486 | MFCD20486232 | 2-chloro-5-(cyclopropylmethoxy)pyrimidine

Storage

Room temperature

Shipped In

ノーマル

Specifications

同義語

FT-0704938 | EN300-7390514 | A882079 | ILLJCQSVKGFRHZ-UHFFFAOYSA-N | SB57300 | SCHEMBL1697756 | AKOS016013061 | DTXSID50702688 | DS-14486 | MFCD20486232 | 2-chloro-5-(cyclopropylmethoxy)pyrimidine

仕様と純度

≥97%

保管条件

Room temperature

入荷

ノーマル

純度

≥97%

名前と識別子

カノニカル・スマイル

C1CC1COC2=CN=C(N=C2)Cl

IUPAC Name

2-chloro-5-(cyclopropylmethoxy)pyrimidine

InChIKey

ILLJCQSVKGFRHZ-UHFFFAOYSA-N

INCHI

1S/C8H9ClN2O/c9-8-10-3-7(4-11-8)12-5-6-1-2-6/h3-4,6H,1-2,5H2

異性体SMILES

C1CC1COC2=CN=C(N=C2)Cl

分子量

184.62

Reaxy-Rn

22584594

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=22584594&ln=

Taxonomic Classification

Taxonomy Tree

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

• Kingdom: Organic compounds
• Superclass: Organic oxygen compounds
• 分類: Organooxygen compounds
• Subclass: Ethers
• Intermediate Tree Nodes: Not available
• Direct Parent: Alkyl aryl ethers
• Alternative Parents: 2-halopyrimidines Aryl chlorides Heteroaromatic compounds Azacyclic compounds Organopnictogen compounds Organonitrogen compounds Organochlorides Hydrocarbon derivatives
• Molecular Framework: Aromatic heteromonocyclic compounds
• Substituents: Alkyl aryl ether - Halopyrimidine - 2-halopyrimidine - Aryl chloride - Aryl halide - Pyrimidine - Heteroaromatic compound - Organoheterocyclic compound - Azacycle - Organic nitrogen compound - Organonitrogen compound - Organochloride - Organohalogen compound - Organopnictogen compound - Hydrocarbon derivative - Aromatic heteromonocyclic compound
• 説明: This compound belongs to the class of organic compounds known as alkyl aryl ethers. These are organic compounds containing the alkyl aryl ether functional group with the generic formula R-O-R' , where R is an alkyl group and R' is an aryl group.
• 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

化学的性質と物理的性質

• 分子量: 184.620 g/mol
• XLogP3: 1.900
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 3
• Exact Mass: 184.04 Da
• Monoisotopic Mass: 184.04 Da
• Topological Polar Surface Area: 35.000 Ų
• Heavy Atom Count: 12
• Formal Charge: 0
• Complexity: 144.000
• 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

よくある質問

How should this product be stored?

Store at room temperature.

How is this product shipped?

This product ships under standard ambient conditions. No temperature-controlled packaging is required.