Basic information
- CAS
85111-28-0- Standard SMILES
OC(CCl)CNCCNCC(O)CCl- InChIKey
CZJWCCGENCEFPM-UHFFFAOYSA-N- Molecular formula
- C8H18Cl2N2O2
- Average molar mass
- 245.14 g/mol
- Monoisotopic mass
- 244.0745332
Names & identifiers
- Preferred name
- 2-Propanol, 1,1'-ethylenediiminobis(3-chloro-
- IUPAC
- 1-chloro-3-[2-[(3-chloro-2-hydroxypropyl)amino]ethylamino]propan-2-ol
Names & synonyms
2-Propanol, 1,1'-ethylenediiminobis(3-chloro-85111-28-0RefChem:1064222BRN 23517991,2-Bis(gamma-chloro-beta-hydroxypropylamino)ethane1,1'-Ethylenediiminobis(3-chloro-2-propanol)2-Propanol, 1,1'-(1,2-ethanediyldiimino)bis(3-chloro-DTXSID7010055031,1'-(Ethane-1,2-diyldiazanediyl)bis(3-chloropropan-2-ol)1,1'-[Ethane-1,2-diylbis(azanediyl)]bis(3-chloropropan-2-ol)
Database identifiers
- CAS
85111-28-0- PubChem CID
- 3069744
- DTXSID
DTXSID701005503- Nikkaji
- J69.771K
Properties
Computed structural properties
- XLogP
- -0.7
- Topological polar surface area
- 64.5 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 9
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 116
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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