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68877-34-9 | N-(3-(2-Ethylhexyloxy)propyl)-1,3-propanediamine
CAS No: 68877-34-9 Catalog No: AG006FZ8 MDL No:
Product Description
Catalog Number:
AG006FZ8
Chemical Name:
N-(3-(2-Ethylhexyloxy)propyl)-1,3-propanediamine
CAS Number:
68877-34-9
Molecular Formula:
C14H32N2O
Molecular Weight:
244.4167
IUPAC Name:
N'-[3-(2-ethylhexoxy)propyl]propane-1,3-diamine
InChI:
InChI=1S/C14H32N2O/c1-3-5-8-14(4-2)13-17-12-7-11-16-10-6-9-15/h14,16H,3-13,15H2,1-2H3
InChI Key:
BUTDSIPPSDVHKV-UHFFFAOYSA-N
SMILES:
CCCCC(COCCCNCCCN)CC
EC Number:
272-560-6
Properties
Complexity:
142
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
244.251g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
244.423g/mol
Monoisotopic Mass:
244.251g/mol
Rotatable Bond Count:
13
Topological Polar Surface Area:
47.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
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