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2-Deoxystreptamine, Dihydrobromide

CAT: 0572-TRC-D263500-500MGSize: 500 mgDry Ice: NoHazardous: No
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CAT#:0572-TRC-D263500-500MGSize:500 mg
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CAS Number
84107-26-6
Synonyms
Streptamine, 2-deoxy-, hydrobromide (1:2); Streptamine, 2-deoxy-, dihydrobromide (9CI); 2-Deoxystreptamine dihydrobromide; 2-Deoxy-D-streptamine dihydrobromide
Hazard Statement
Causes skin irritation
Purity
>95% (HPLC)
Smiles
Br.Br.N[C@@H]1C[C@H](N)[C@@H](O)[C@H](O)[C@H]1O
Molecular Formula
C6 H14 N2 O3 . 2 Br H
Molecular Weight
324.01
InChI
InChI=1S/C6H14N2O3.2BrH/c7-2-1-3(8)5(10)6(11)4(2)9;;/h2-6,9-11H,1,7-8H2;2*1H/t2-,3+,4+,5-,6-;;
Additionnal Information
IUPAC name: (1S,3R,4S,6R)-4,6-diaminocyclohexane-1,2,3-triol;dihydrobromide
Shipping Conditions
Room Temperature
Storage Conditions
-20°C

Chemical Information

2-Deoxystreptamine dihydrobromide
CAS Number84107-26-6
PubChem CID71307487
IUPAC Name(1R,3S,4R,6S)-4,6-diaminocyclohexane-1,2,3-triol;dihydrobromide
Molecular FormulaC6H16Br2N2O3
Molecular Weight324.01
Topological Polar Surface Area113
Hydrogen Bond Donor Count7
Hydrogen Bond Acceptor Count5
Rotatable Bond Count0
Heavy Atom Count13
Formal Charge0
Complexity130
SMILES
C1[C@H]([C@@H](C([C@@H]([C@H]1N)O)O)O)N.Br.Br
InChI
InChI=1S/C6H14N2O3.2BrH/c7-2-1-3(8)5(10)6(11)4(2)9;;/h2-6,9-11H,1,7-8H2;2*1H/t2-,3+,4+,5-,6?;;
InChIKey
FQPOWLZRZNUTOR-IKNHPHTKSA-N
Chemical Structure
2D Structure
2D structure of 2-Deoxystreptamine dihydrobromide
CAS: 84107-26-6
CID: 71307487
Formula: C6H16Br2N2O3
MW: 324.01
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight324.01
Hydrogen Bond Donor Count7
Hydrogen Bond Acceptor Count5
Rotatable Bond Count0
Exact Mass323.95072
Monoisotopic Mass321.95277
Topological Polar Surface Area113 Ų
Heavy Atom Count13
Formal Charge0
Complexity130
Isotope Atom Count0
Defined Atom Stereocenter Count4
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count3
Compound Is CanonicalizedYes