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131467-06-6 | Pyrimidine, 2-chloro-5-ethenyl-
CAS No: 131467-06-6 Catalog No: AG000W8Q MDL No:MFCD11040635
Product Description
Catalog Number:
AG000W8Q
Chemical Name:
Pyrimidine, 2-chloro-5-ethenyl-
CAS Number:
131467-06-6
Molecular Formula:
C6H5ClN2
Molecular Weight:
140.5703
MDL Number:
MFCD11040635
IUPAC Name:
2-chloro-5-ethenylpyrimidine
InChI:
InChI=1S/C6H5ClN2/c1-2-5-3-8-6(7)9-4-5/h2-4H,1H2
InChI Key:
LOMHPDKAIATDPF-UHFFFAOYSA-N
SMILES:
C=Cc1cnc(nc1)Cl
Properties
Complexity:
97.2
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
140.014g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
140.57g/mol
Monoisotopic Mass:
140.014g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
25.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
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