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88945-23-7 | Pyrimidine, 4,6-dichloro-2-(2-phenylethyl)-5-propyl-
CAS No: 88945-23-7 Catalog No: AG0047YC MDL No:
Product Description
Catalog Number:
AG0047YC
Chemical Name:
Pyrimidine, 4,6-dichloro-2-(2-phenylethyl)-5-propyl-
CAS Number:
88945-23-7
Molecular Formula:
C15H16Cl2N2
Molecular Weight:
295.2069
IUPAC Name:
4,6-dichloro-2-(2-phenylethyl)-5-propylpyrimidine
InChI:
InChI=1S/C15H16Cl2N2/c1-2-6-12-14(16)18-13(19-15(12)17)10-9-11-7-4-3-5-8-11/h3-5,7-8H,2,6,9-10H2,1H3
InChI Key:
MJKPTZXIXPHPCN-UHFFFAOYSA-N
SMILES:
CCCc1c(Cl)nc(nc1Cl)CCc1ccccc1
Properties
Complexity:
245
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
294.069g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
295.207g/mol
Monoisotopic Mass:
294.069g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
25.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.7
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