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133300-00-2 | 3-Pyridinecarboximidamide, N-cyano-N'-(2-phenylethyl)-
CAS No: 133300-00-2 Catalog No: AG0014KT MDL No:
Product Description
Catalog Number:
AG0014KT
Chemical Name:
3-Pyridinecarboximidamide, N-cyano-N'-(2-phenylethyl)-
CAS Number:
133300-00-2
Molecular Formula:
C15H14N4
Molecular Weight:
250.2985
IUPAC Name:
N-cyano-N-(2-phenylethyl)pyridine-3-carboximidamide
InChI:
InChI=1S/C15H14N4/c16-12-19(10-8-13-5-2-1-3-6-13)15(17)14-7-4-9-18-11-14/h1-7,9,11,17H,8,10H2
InChI Key:
MQGGYAJLTKUGSM-UHFFFAOYSA-N
SMILES:
N#CNC(=NCCc1ccccc1)c1cccnc1
Properties
Complexity:
337
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
250.122g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
250.305g/mol
Monoisotopic Mass:
250.122g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
63.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
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