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141963-43-1 | 2-Propanol, 1-(1-methylethoxy)-3-(octylamino)-
CAS No: 141963-43-1 Catalog No: AG001HGH MDL No:
Product Description
Catalog Number:
AG001HGH
Chemical Name:
2-Propanol, 1-(1-methylethoxy)-3-(octylamino)-
CAS Number:
141963-43-1
Molecular Formula:
C14H31NO2
Molecular Weight:
245.4014
IUPAC Name:
1-(octylamino)-3-propan-2-yloxypropan-2-ol
InChI:
InChI=1S/C14H31NO2/c1-4-5-6-7-8-9-10-15-11-14(16)12-17-13(2)3/h13-16H,4-12H2,1-3H3
InChI Key:
LPTXCVWUIJLTJF-UHFFFAOYSA-N
SMILES:
CCCCCCCCNCC(COC(C)C)O
Properties
Complexity:
151
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
245.235g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
245.407g/mol
Monoisotopic Mass:
245.235g/mol
Rotatable Bond Count:
12
Topological Polar Surface Area:
41.5A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2
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