Home Nitriles 4-(naphthalen-1-yloxy)butanenitrile

4-(naphthalen-1-yloxy)butanenitrile

CAS No.:
1016860-12-0
Catalog Number:
AG01A9Z2
Molecular Formula:
C14H13NO
Molecular Weight:
211.2591
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Product Description
Catalog Number:
AG01A9Z2
Chemical Name:
4-(naphthalen-1-yloxy)butanenitrile
CAS Number:
1016860-12-0
Molecular Formula:
C14H13NO
Molecular Weight:
211.2591
MDL Number:
MFCD09944811
IUPAC Name:
4-naphthalen-1-yloxybutanenitrile
InChI:
InChI=1S/C14H13NO/c15-10-3-4-11-16-14-9-5-7-12-6-1-2-8-13(12)14/h1-2,5-9H,3-4,11H2
InChI Key:
OCTKWQHDXPQFBP-UHFFFAOYSA-N
SMILES:
N#CCCCOc1cccc2c1cccc2
Properties
Complexity:
255  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
211.1g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
211.264g/mol
Monoisotopic Mass:
211.1g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
33A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7  
Properties