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10061-68-4 | 1,3-Propanediamine, N1,N3-diethyl-
CAS No: 10061-68-4 Catalog No: AG0002HJ MDL No:MFCD00009036
Product Description
Catalog Number:
AG0002HJ
Chemical Name:
1,3-Propanediamine, N1,N3-diethyl-
CAS Number:
10061-68-4
Molecular Formula:
C7H18N2
Molecular Weight:
130.2312
MDL Number:
MFCD00009036
IUPAC Name:
N,N'-diethylpropane-1,3-diamine
InChI:
InChI=1S/C7H18N2/c1-3-8-6-5-7-9-4-2/h8-9H,3-7H2,1-2H3
InChI Key:
BEPGHZIEOVULBU-UHFFFAOYSA-N
SMILES:
CCNCCCNCC
EC Number:
233-200-3
UNII:
Q9WI8J247H
NSC Number:
137826
Properties
Complexity:
40.2
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
130.147g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
130.235g/mol
Monoisotopic Mass:
130.147g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
24.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5
Literature
| Title | Journal |
|---|---|
| Synthesis, structural, and biological evaluation of bis-heteroarylmaleimides and bis-heterofused imides. | Bioorganic & medicinal chemistry 20110915 |
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