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25199-00-2 | Pyrimidine, 4-chloro-5-propyl-
CAS No: 25199-00-2 Catalog No: AG002QV7 MDL No:MFCD09971219
Product Description
Catalog Number:
AG002QV7
Chemical Name:
Pyrimidine, 4-chloro-5-propyl-
CAS Number:
25199-00-2
Molecular Formula:
C7H9ClN2
Molecular Weight:
156.6128
MDL Number:
MFCD09971219
IUPAC Name:
4-chloro-5-propylpyrimidine
InChI:
InChI=1S/C7H9ClN2/c1-2-3-6-4-9-5-10-7(6)8/h4-5H,2-3H2,1H3
InChI Key:
XFPJNYIBYZTJES-UHFFFAOYSA-N
SMILES:
CCCc1cncnc1Cl
Properties
Complexity:
97.6
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
156.045g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
156.613g/mol
Monoisotopic Mass:
156.045g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
25.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
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