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122909-82-4 | 1,3-Propanediamine, 2,2-dihexyl-
CAS No: 122909-82-4 Catalog No: AG000JRW MDL No:
Product Description
Catalog Number:
AG000JRW
Chemical Name:
1,3-Propanediamine, 2,2-dihexyl-
CAS Number:
122909-82-4
Molecular Formula:
C15H34N2
Molecular Weight:
242.4439
IUPAC Name:
2,2-dihexylpropane-1,3-diamine
InChI:
InChI=1S/C15H34N2/c1-3-5-7-9-11-15(13-16,14-17)12-10-8-6-4-2/h3-14,16-17H2,1-2H3
InChI Key:
UDYVMSBSJYHTPZ-UHFFFAOYSA-N
SMILES:
CCCCCCC(CCCCCC)(CN)CN
Properties
Complexity:
139
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
242.272g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
242.451g/mol
Monoisotopic Mass:
242.272g/mol
Rotatable Bond Count:
12
Topological Polar Surface Area:
52A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.6
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