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10150-40-0 | 1,2-Ethanediamine, N1,N2-dicyclopentyl-, hydrochloride (1:2)
CAS No: 10150-40-0 Catalog No: AG0004NW MDL No:
Product Description
Catalog Number:
AG0004NW
Chemical Name:
1,2-Ethanediamine, N1,N2-dicyclopentyl-, hydrochloride (1:2)
CAS Number:
10150-40-0
Molecular Formula:
C12H26Cl2N2
Molecular Weight:
269.2542
IUPAC Name:
N,N'-dicyclopentylethane-1,2-diamine
InChI:
InChI=1S/C12H24N2/c1-2-6-11(5-1)13-9-10-14-12-7-3-4-8-12/h11-14H,1-10H2
InChI Key:
LOZMWNGDZJWPDR-UHFFFAOYSA-N
SMILES:
C1CCC(C1)NCCNC1CCCC1.Cl.Cl
Properties
Complexity:
128
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
196.194g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
196.338g/mol
Monoisotopic Mass:
196.194g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
24.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
Literature
| Title | Journal |
|---|---|
| Structure-activity studies leading to ethambutol, a new type of antituberculous compound. | Annals of the New York Academy of Sciences 19660420 |
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