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1015845-71-2 | Pyrimidine, 4-chloro-6-(4-methyl-1H-pyrazol-1-yl)-
CAS No: 1015845-71-2 Catalog No: AG0004VE MDL No:MFCD08691760
Product Description
Catalog Number:
AG0004VE
Chemical Name:
Pyrimidine, 4-chloro-6-(4-methyl-1H-pyrazol-1-yl)-
CAS Number:
1015845-71-2
Molecular Formula:
C8H7ClN4
Molecular Weight:
194.6210
MDL Number:
MFCD08691760
IUPAC Name:
4-chloro-6-(4-methylpyrazol-1-yl)pyrimidine
InChI:
InChI=1S/C8H7ClN4/c1-6-3-12-13(4-6)8-2-7(9)10-5-11-8/h2-5H,1H3
InChI Key:
FMSZLROESHSQPC-UHFFFAOYSA-N
SMILES:
Cc1cnn(c1)c1ncnc(c1)Cl
Properties
Complexity:
178
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
194.036g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
194.622g/mol
Monoisotopic Mass:
194.036g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
43.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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