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121554-14-1 | Benzonitrile, 2-(octyloxy)-
CAS No: 121554-14-1 Catalog No: AG00159V MDL No:
Product Description
Catalog Number:
AG00159V
Chemical Name:
Benzonitrile, 2-(octyloxy)-
CAS Number:
121554-14-1
Molecular Formula:
C15H21NO
Molecular Weight:
231.3333
IUPAC Name:
2-octoxybenzonitrile
InChI:
InChI=1S/C15H21NO/c1-2-3-4-5-6-9-12-17-15-11-8-7-10-14(15)13-16/h7-8,10-11H,2-6,9,12H2,1H3
InChI Key:
FDYQEPJBEYRYSL-UHFFFAOYSA-N
SMILES:
CCCCCCCCOc1ccccc1C#N
Properties
Complexity:
230
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
231.162g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
231.339g/mol
Monoisotopic Mass:
231.162g/mol
Rotatable Bond Count:
8
Topological Polar Surface Area:
33A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5
Literature
| Title | Journal |
|---|---|
| Photocurable ISFET for anionic surfactants. Monitoring of photodegradation processes. | Talanta 20010621 |
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