1,1'-(Ethane-1,2-diyldiazanediyl)bis(3-chloropropan-2-ol)--hydrogen chloride (1/2)
Basic information
- CAS
85095-76-7- Standard SMILES
Cl.Cl.OC(CCl)CNCCNCC(O)CCl- InChIKey
XZQPUUYZRSPCRU-UHFFFAOYSA-N- Molecular formula
- C8H20Cl4N2O2
- Average molar mass
- 318.1 g/mol
- Monoisotopic mass
- 316.027889
Names & identifiers
- Preferred name
- 1,1'-(Ethane-1,2-diyldiazanediyl)bis(3-chloropropan-2-ol)--hydrogen chloride (1/2)
- IUPAC
- 1-chloro-3-[2-[(3-chloro-2-hydroxypropyl)amino]ethylamino]propan-2-ol;dihydrochloride
Names & synonyms
85095-76-7DTXSID3010054561,1'-(Ethane-1,2-diyldiazanediyl)bis(3-chloropropan-2-ol)--hydrogen chloride (1/2)RefChem:1051546DTXCID5014323382-Propanol, 1,1'-ethylenediiminobis(3-chloro-, dihydrochloride1,2-Bis-(gamma-chloro-beta-hydroxypropylamino)ethane dihydrochloride1,1'-Ethylenediiminobis(3-chloro-2-propanol) dihydrochloride2-Propanol, 1,1'-(1,2-ethanediyldiimino)bis(3-chloro-, dihydrochloride1,1'-[Ethane-1,2-diylbis(azanediyl)]bis(3-chloropropan-2-ol)--hydrogen chloride (1/2)
Database identifiers
- CAS
85095-76-7- PubChem CID
- 3069743
- DTXSID
DTXSID301005456
Properties
Computed structural properties
- Topological polar surface area
- 64.5 Ų
- Hydrogen bond donors
- 6
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 9
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 116
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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