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1254055-46-3 | 2-Pyrazinecarbonitrile, 3,5-dichloro-6-ethyl-
CAS No: 1254055-46-3 Catalog No: AG000NMN MDL No:MFCD28099382
Product Description
Catalog Number:
AG000NMN
Chemical Name:
2-Pyrazinecarbonitrile, 3,5-dichloro-6-ethyl-
CAS Number:
1254055-46-3
Molecular Formula:
C7H5Cl2N3
Molecular Weight:
202.0407
MDL Number:
MFCD28099382
IUPAC Name:
3,5-dichloro-6-ethylpyrazine-2-carbonitrile
InChI:
InChI=1S/C7H5Cl2N3/c1-2-4-6(8)12-7(9)5(3-10)11-4/h2H2,1H3
InChI Key:
BOMIYODDZMTKBX-UHFFFAOYSA-N
SMILES:
CCc1nc(C#N)c(nc1Cl)Cl
Properties
Complexity:
200
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
200.986g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
202.038g/mol
Monoisotopic Mass:
200.986g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
49.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7
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