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16728-68-0 | 1-Hexanamine, 6-phenoxy-
CAS No: 16728-68-0 Catalog No: AG001X9J MDL No:
Product Description
Catalog Number:
AG001X9J
Chemical Name:
1-Hexanamine, 6-phenoxy-
CAS Number:
16728-68-0
Molecular Formula:
C12H19NO
Molecular Weight:
193.2854
IUPAC Name:
6-phenoxyhexan-1-amine
InChI:
InChI=1S/C12H19NO/c13-10-6-1-2-7-11-14-12-8-4-3-5-9-12/h3-5,8-9H,1-2,6-7,10-11,13H2
InChI Key:
DCAYAQYLHBHPAS-UHFFFAOYSA-N
SMILES:
NCCCCCCOc1ccccc1
Properties
Complexity:
122
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
193.147g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
193.29g/mol
Monoisotopic Mass:
193.147g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
35.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
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