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16728-62-4 | 1-Propanamine, 3-(nonyloxy)-
CAS No: 16728-62-4 Catalog No: AG001X9N MDL No:
Product Description
Catalog Number:
AG001X9N
Chemical Name:
1-Propanamine, 3-(nonyloxy)-
CAS Number:
16728-62-4
Molecular Formula:
C12H27NO
Molecular Weight:
201.3489
IUPAC Name:
3-nonoxypropan-1-amine
InChI:
InChI=1S/C12H27NO/c1-2-3-4-5-6-7-8-11-14-12-9-10-13/h2-13H2,1H3
InChI Key:
ZINQYRQLEDIWQS-UHFFFAOYSA-N
SMILES:
CCCCCCCCCOCCCN
EC Number:
272-242-7
Properties
Complexity:
96.3
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
201.209g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
201.354g/mol
Monoisotopic Mass:
201.209g/mol
Rotatable Bond Count:
11
Topological Polar Surface Area:
35.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5
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