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Also known as: Propane-1,2-diamine;dihydrochloride, 62063-19-8, (s)-(-)-diaminopropane dihydrochloride, Schembl202468, 1,2-diaminopropane dihydrochloride, Akos025243742
Molecular Formula
C3H12Cl2N2
Molecular Weight
147.04  g/mol
InChI Key
AEIAMRMQKCPGJR-UHFFFAOYSA-N

CAS 62063-19-8
1 2D Structure

CAS 62063-19-8

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
propane-1,2-diamine;dihydrochloride
2.1.2 InChI
InChI=1S/C3H10N2.2ClH/c1-3(5)2-4;;/h3H,2,4-5H2,1H3;2*1H
2.1.3 InChI Key
AEIAMRMQKCPGJR-UHFFFAOYSA-N
2.1.4 Canonical SMILES
CC(CN)N.Cl.Cl
2.2 Synonyms
2.2.1 Depositor-Supplied Synonyms

1. Propane-1,2-diamine;dihydrochloride

2. 62063-19-8

3. (s)-(-)-diaminopropane Dihydrochloride

4. Schembl202468

5. 1,2-diaminopropane Dihydrochloride

6. Akos025243742

7. Sb35114

8. Sb35115

9. Ac-22047

10. Ft-0605121

11. Ft-0605293

12. (s)-(-)-1,2-propylenediaminedihydrochloride

13. A813938

14. Propane-1,2-diamine Dihydrochloride;(s)-1,2-diaminopropane 2hcl

2.3 Create Date
2005-03-27
3 Chemical and Physical Properties
Molecular Weight 147.04 g/mol
Molecular Formula C3H12Cl2N2
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count2
Rotatable Bond Count1
Exact Mass146.0377538 g/mol
Monoisotopic Mass146.0377538 g/mol
Topological Polar Surface Area52 Ų
Heavy Atom Count7
Formal Charge0
Complexity20.9
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count3

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