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59021-15-7 | 3-iodo-2,5-diMethylpyrazine
CAS No: 59021-15-7 Catalog No: AG00EIF5 MDL No:MFCD20484141
Product Description
Catalog Number:
AG00EIF5
Chemical Name:
3-iodo-2,5-diMethylpyrazine
CAS Number:
59021-15-7
Molecular Formula:
C6H7IN2
Molecular Weight:
234.0376
MDL Number:
MFCD20484141
IUPAC Name:
3-iodo-2,5-dimethylpyrazine
InChI:
InChI=1S/C6H7IN2/c1-4-3-8-5(2)6(7)9-4/h3H,1-2H3
InChI Key:
STLFJVQEKULVQV-UHFFFAOYSA-N
SMILES:
Cc1cnc(c(n1)I)C
Properties
Complexity:
97.1
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
233.965g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
234.04g/mol
Monoisotopic Mass:
233.965g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
25.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2
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