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Home > Bromides > 1443355-16-5
1443355-16-5 | 6-(2-Bromo-4-chloro-phenoxy)hexanenitrile
CAS No: 1443355-16-5 Catalog No: AG01FBP8 MDL No:
Product Description
Catalog Number:
AG01FBP8
Chemical Name:
6-(2-Bromo-4-chloro-phenoxy)hexanenitrile
CAS Number:
1443355-16-5
Molecular Formula:
C12H13BrClNO
Molecular Weight:
302.5947
IUPAC Name:
6-(2-bromo-4-chlorophenoxy)hexanenitrile
InChI:
InChI=1S/C12H13BrClNO/c13-11-9-10(14)5-6-12(11)16-8-4-2-1-3-7-15/h5-6,9H,1-4,8H2
InChI Key:
XQTYNDDGKFBYNC-UHFFFAOYSA-N
SMILES:
N#CCCCCCOc1ccc(cc1Br)Cl
Properties
Complexity:
240
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
300.987g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
302.596g/mol
Monoisotopic Mass:
300.987g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
33A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4
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