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101986-68-9 | Acetamide, N-[4-(2-pyrazinyl)phenyl]-
CAS No: 101986-68-9 Catalog No: AG000660 MDL No:
Product Description
Catalog Number:
AG000660
Chemical Name:
Acetamide, N-[4-(2-pyrazinyl)phenyl]-
CAS Number:
101986-68-9
Molecular Formula:
C12H11N3O
Molecular Weight:
213.2352
IUPAC Name:
N-(4-pyrazin-2-ylphenyl)acetamide
InChI:
InChI=1S/C12H11N3O/c1-9(16)15-11-4-2-10(3-5-11)12-8-13-6-7-14-12/h2-8H,1H3,(H,15,16)
InChI Key:
HQDBKEGCEORVMR-UHFFFAOYSA-N
SMILES:
CC(=O)Nc1ccc(cc1)c1cnccn1
Properties
Complexity:
236
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
213.09g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
213.24g/mol
Monoisotopic Mass:
213.09g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
54.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6
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