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1260860-26-1 | Pyrimidine, 2,4-dichloro-5-(1H-pyrazol-1-yl)-
CAS No: 1260860-26-1 Catalog No: AG000RGY MDL No:MFCD11109898
Product Description
Catalog Number:
AG000RGY
Chemical Name:
Pyrimidine, 2,4-dichloro-5-(1H-pyrazol-1-yl)-
CAS Number:
1260860-26-1
Molecular Formula:
C7H4Cl2N4
Molecular Weight:
215.0395
MDL Number:
MFCD11109898
IUPAC Name:
2,4-dichloro-5-pyrazol-1-ylpyrimidine
InChI:
InChI=1S/C7H4Cl2N4/c8-6-5(4-10-7(9)12-6)13-3-1-2-11-13/h1-4H
InChI Key:
RNUCSZLRGJAHLJ-UHFFFAOYSA-N
SMILES:
Clc1ncc(c(n1)Cl)n1cccn1
Properties
Complexity:
180
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
213.981g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
215.037g/mol
Monoisotopic Mass:
213.981g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
43.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
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