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Home > Bromides > 1443343-41-6
1443343-41-6 | 5-(3-Bromo-6-methoxy-phenoxy)pentanenitrile
CAS No: 1443343-41-6 Catalog No: AG01FB0V MDL No:
Product Description
Catalog Number:
AG01FB0V
Chemical Name:
5-(3-Bromo-6-methoxy-phenoxy)pentanenitrile
CAS Number:
1443343-41-6
Molecular Formula:
C12H14BrNO2
Molecular Weight:
284.1491
IUPAC Name:
5-(5-bromo-2-methoxyphenoxy)pentanenitrile
InChI:
InChI=1S/C12H14BrNO2/c1-15-11-6-5-10(13)9-12(11)16-8-4-2-3-7-14/h5-6,9H,2-4,8H2,1H3
InChI Key:
ARFXJZOYCMTGNS-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1OCCCCC#N)Br
Properties
Complexity:
238
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
283.021g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
284.153g/mol
Monoisotopic Mass:
283.021g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
42.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3
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