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1017023-76-5 | 6-[(prop-2-en-1-yl)amino]pyridine-3-carbonitrile
CAS No: 1017023-76-5 Catalog No: AG01FLZN MDL No:MFCD09936460
Product Description
Catalog Number:
AG01FLZN
Chemical Name:
6-[(prop-2-en-1-yl)amino]pyridine-3-carbonitrile
CAS Number:
1017023-76-5
Molecular Formula:
C9H9N3
Molecular Weight:
159.1879
MDL Number:
MFCD09936460
IUPAC Name:
6-(prop-2-enylamino)pyridine-3-carbonitrile
InChI:
InChI=1S/C9H9N3/c1-2-5-11-9-4-3-8(6-10)7-12-9/h2-4,7H,1,5H2,(H,11,12)
InChI Key:
PKUUCDFHGNZHTF-UHFFFAOYSA-N
SMILES:
C=CCNc1ccc(cn1)C#N
Properties
Complexity:
191
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
159.08g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
159.192g/mol
Monoisotopic Mass:
159.08g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
48.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
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