Benzonitrile, 2-(butylamino)-


Chemical Name: Benzonitrile, 2-(butylamino)-
CAS Number: 5589-61-7
Product Number: AG00DKLE(AGN-PC-040T1Z)
Synonyms:
MDL No:
Molecular Formula: C11H14N2
Molecular Weight: 174.2423

Identification/Properties


Computed Properties
Molecular Weight:
174.247g/mol
XLogP3:
3.1
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
4
Exact Mass:
174.116g/mol
Monoisotopic Mass:
174.116g/mol
Topological Polar Surface Area:
35.8A^2
Heavy Atom Count:
13
Formal Charge:
0
Complexity:
180
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
N/A
Signal Word:
UN#:
-
Hazard Statements:
-
Precautionary Statements:
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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