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13535-13-2 | 2-Amino-5-phenylpyrazine
CAS No: 13535-13-2 Catalog No: AG003GHO MDL No:MFCD01646266
Product Description
Catalog Number:
AG003GHO
Chemical Name:
2-Amino-5-phenylpyrazine
CAS Number:
13535-13-2
Molecular Formula:
C10H9N3
Molecular Weight:
171.1986
MDL Number:
MFCD01646266
IUPAC Name:
5-phenylpyrazin-2-amine
InChI:
InChI=1S/C10H9N3/c11-10-7-12-9(6-13-10)8-4-2-1-3-5-8/h1-7H,(H2,11,13)
InChI Key:
KJAKXVBZQBPPOB-UHFFFAOYSA-N
SMILES:
Nc1cnc(cn1)c1ccccc1
Properties
Complexity:
154
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
171.08g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
171.203g/mol
Monoisotopic Mass:
171.08g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
51.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1
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