Benzeneacetonitrile, 3-(cyclopentyloxy)-4-methoxy-


Chemical Name: Benzeneacetonitrile, 3-(cyclopentyloxy)-4-methoxy-
CAS Number: 141333-36-0
Product Number: AG001G89(AGN-PC-0N9JXE)
Synonyms:
MDL No: MFCD09834353
Molecular Formula: C14H17NO2
Molecular Weight: 231.2903

Identification/Properties


Computed Properties
Molecular Weight:
231.295g/mol
XLogP3:
2.4
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
4
Exact Mass:
231.126g/mol
Monoisotopic Mass:
231.126g/mol
Topological Polar Surface Area:
42.2A^2
Heavy Atom Count:
17
Formal Charge:
0
Complexity:
277
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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