Products
  • Products
  • Buy offers
  • Encyclopedia
  • Msds lib
  • Synthesis
  • Reach Info
  • Suppliers
Home> Hot Product Listed T   > T6689373
937271-43-7 structure

T6689373

Iupac Name:3-(2-chloropyrimidin-4-yl)phenol
CAS No.:937271-43-7
Molecular Weight:206.629
Molecular Formula:C19H26N4O2 (isomer)
Names and Identifiers
Synonyms

MCULE-4502683612 MOLPORT-009-109-771 n-[(furan-2-yl)methyl]-2-(3-methoxyphenyl)-n-(prop-2-yn-1-yl)acetamide Z913693596 ZINC58007914

Inchi
InChI=1S/C10H7ClN2O/c11-10-12-5-4-9(13-10)7-2-1-3-8(14)6-7/h1-6,14H
InChkey
FBHTXOQEDBGING-UHFFFAOYSA-N
Canonical Smiles
C1=CC(=CC(=C1)O)C2=NC(=NC=C2)Cl
Computational chemical data
  • Molecular Weight:206.629g/mol
  • Molecular Formula:C19H26N4O2
  • Compound Is Canonicalized:True
  • Exact Mass:206.025
  • Monoisotopic Mass:206.025
  • Complexity:191
  • Rotatable Bond Count:1
  • Hydrogen Bond Donor Count:1
  • Hydrogen Bond Acceptor Count:3
  • Topological Polar Surface Area:46A^2
  • Heavy Atom Count:14
  • Defined Atom Stereocenter Count:0
  • Undefined Atom Stereocenter Count:0
  • Defined Bond Stereocenter Count:0
  • Undefined Bond Stereocenter Count:0
  • Isotope Atom Count:0
  • Covalently-Bonded Unit Count:1
  • CACTVS Substructure Key Fingerprint: AAADcYBzIAAEAAAAAAAAAAAAAAAAAAAAAAA8QAAAAAAAAAABwAAAHgIACAAADAzBngQ9lpYIEgCg AzRnZACCgCkxIqAJ2CA+bJiILqLC2dOEdAhswBNI2CewwLAOAAABAAAAAAAAAAIAAAAAAAAAAAAA AA==
 
<