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799270-82-9

799270-82-9 | Pyrimidine, 2,4-dichloro-6-(1E)-1-heptenyl-

CAS No: 799270-82-9 Catalog No: AG005F6D MDL No:

Product Description

Catalog Number:
AG005F6D
Chemical Name:
Pyrimidine, 2,4-dichloro-6-(1E)-1-heptenyl-
CAS Number:
799270-82-9
Molecular Formula:
C11H14Cl2N2
Molecular Weight:
245.1483
IUPAC Name:
2,4-dichloro-6-hept-1-enylpyrimidine
InChI:
InChI=1S/C11H14Cl2N2/c1-2-3-4-5-6-7-9-8-10(12)15-11(13)14-9/h6-8H,2-5H2,1H3
InChI Key:
JWBQGTLRXBVSOG-UHFFFAOYSA-N
SMILES:
CCCCC/C=C/c1cc(Cl)nc(n1)Cl

Properties

Complexity:
197  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
244.053g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
245.147g/mol
Monoisotopic Mass:
244.053g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
25.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1  
XLogP3:
5.2  

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