1 3-DIAMINOACETONE DIHYDROCHLORIDE

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Product Information

Molecular Formula
C3H8N2O.2ClH.H2O
Molecular Weight
179.05
Description
Stability: Solution may discolour on heating.Applications: 1,3-Diaminoacetone Dihydrochloride Monohydrate is a useful research chemical.
Synonyms
1,3-diaminopropan-2-one; hydrate; dihydrochloride; 1,3-Diaminoacetonedihydrochloridemonohydrate; 207226-24-2; NWGWIZCBVTVWAW-UHFFFAOYSA-N
IUPAC Name
1,3-diaminopropan-2-onehydratedihydrochloride
SMILES
C(C(=O)CN)N.O.Cl.Cl
InChI
InChI=1S/C3H8N2O.2ClH.H2O/c4-1-3(6)2-5;;;/h1-2,4-5H2;2*1H;1H2
InChI Key
NWGWIZCBVTVWAW-UHFFFAOYSA-N
Melting Point
179°C (dec.)(lit.)
Purity
95%
Appearance
Pale Brown Solid
Storage
Hygroscopic, -20°C Freezer, Under inert atmosphere

Computed Properties

Hydrogen Bond Donor Count
5
Hydrogen Bond Acceptor Count
4
Rotatable Bond Count
2
Exact Mass
178.0275830 g/mol
Monoisotopic Mass
178.0275830 g/mol
Topological Polar Surface Area
70.1Ų
Heavy Atom Count
9
Formal Charge
0
Complexity
46.8
Isotope Atom Count
0
Defined Atom Stereocenter Count
0
Undefined Atom Stereocenter Count
0
Defined Bond Stereocenter Count
0
Undefined Bond Stereocenter Count
0
Covalently-Bonded Unit Count
4
Compound Is Canonicalized
Yes
The molarity calculator equation

Mass (g) = Concentration (mol/L) × Volume (L) × Molecular Weight (g/mol)

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The dilution calculator equation

Concentration (start) × Volume (start) = Concentration (final) × Volume (final)

This equation is commonly abbreviated as: C1V1 = C2V2

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