4-(Dimethoxymethyl)-2-methoxypyrimidine - ≥97% , CAS No.193746-84-8

CAS: 193746-84-8 Cat. No.: D191840 Formula: C₈H₁₂N₂O₃ Peso molecolare: 184.19

GRADE & PURITY ≥97%

Synonyms

AMY16413 | DS-2999 | 4-(Dimethoxymethyl)-2-methoxypyrimidine | 4-(dimethoxymethyl)-2-methoxy-pyrimidine | MFCD08275991 | 4-DIMETHOXYMETHYL-2-METHOXYPYRIMIDINE | 4-DIMETHOXYMETHYL-2-METHOXY-PYRIMIDINE | DTXSID80611254 | SY115309 | SB57653 | SCHEMBL4978265

Storage

Room temperature

Shipped In

Normal

Specifications

Sinonimi

AMY16413 | DS-2999 | 4-(Dimethoxymethyl)-2-methoxypyrimidine | 4-(dimethoxymethyl)-2-methoxy-pyrimidine | MFCD08275991 | 4-DIMETHOXYMETHYL-2-METHOXYPYRIMIDINE | 4-DIMETHOXYMETHYL-2-METHOXY-PYRIMIDINE | DTXSID80611254 | SY115309 | SB57653 | SCHEMBL4978265

Specifiche e purezza

≥97%

Condizioni di conservazione di stoccaggio

Room temperature

Spedito in

Normal

Purezza

≥97%

Nomi e identificatori

Sorrisi canonici

COC1=NC=CC(=N1)C(OC)OC

IUPAC Name

4-(dimethoxymethyl)-2-methoxypyrimidine

InChIKey

GEIHKDMHTFBNOP-UHFFFAOYSA-N

INCHI

1S/C8H12N2O3/c1-11-7(12-2)6-4-5-9-8(10-6)13-3/h4-5,7H,1-3H3

Isomeri SMILES

COC1=NC=CC(=N1)C(OC)OC

Peso molecolare

184.19

Reaxy-Rn

13574158

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=13574158&ln=

Taxonomic Classification

Taxonomy Tree

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

• Kingdom: Organic compounds
• Superclass: Organic oxygen compounds
• Classe: Organooxygen compounds
• Subclass: Ethers
• Intermediate Tree Nodes: Not available
• Direct Parent: Alkyl aryl ethers
• Alternative Parents: Pyrimidines and pyrimidine derivatives Heteroaromatic compounds Azacyclic compounds Acetals Organopnictogen compounds Organonitrogen compounds Hydrocarbon derivatives
• Molecular Framework: Aromatic heteromonocyclic compounds
• Substituents: Alkyl aryl ether - Pyrimidine - Heteroaromatic compound - Azacycle - Organoheterocyclic compound - Acetal - Organic nitrogen compound - Organopnictogen compound - Hydrocarbon derivative - Organonitrogen compound - Aromatic heteromonocyclic compound
• Descrizione: 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

Proprietà chimiche e fisiche

• Peso molecolare: 184.190 g/mol
• XLogP3: 0.200
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 4
• Exact Mass: 184.085 Da
• Monoisotopic Mass: 184.085 Da
• Topological Polar Surface Area: 53.500 Ų
• Heavy Atom Count: 13
• Formal Charge: 0
• Complexity: 141.000
• 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