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4,7,10,13-Tetraazahexadecane-2,15-diol

HCID 109296
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Basic information

CAS
68310-62-3
Standard SMILES
CC(O)CNCCNCCNCCNCC(C)O
InChIKey
GKIPXBGKRKVRLA-UHFFFAOYSA-N
Molecular formula
C12H30N4O2
Average molar mass
262.39 g/mol
Monoisotopic mass
262.23687621

Names & identifiers

Preferred name
4,7,10,13-Tetraazahexadecane-2,15-diol
IUPAC
1-[2-[2-[2-(2-hydroxypropylamino)ethylamino]ethylamino]ethylamino]propan-2-ol
English name
4,7,10,13-tetraazahexadecane-2,15-diol
Molecular formula
C12H30N4O2
Molecular weight
262.39

Names & synonyms

4,7,10,13-Tetraazahexadecane-2,15-diol68310-62-3EINECS 269-721-8DTXSID40887332RefChem:96701DTXCID001026633269-721-8SCHEMBL14661169GKIPXBGKRKVRLA-UHFFFAOYSA-NNS00059788

Database identifiers

CAS
68310-62-3
PubChem CID
109296
DTXSID
DTXSID40887332
EC Number
269-721-8
Nikkaji
J334.127E

Properties

Computed structural properties

XLogP
-2.1
Topological polar surface area
88.6 Ų
Hydrogen bond donors
6
Hydrogen bond acceptors
6
Rotatable bonds
13
Heavy atoms
18
Formal charge
0
Complexity
154

Physicochemical properties

EPA Substance Registry System
4 · 4,7,10,13-Tetraazahexadecane-2,15-diol (68310-62-3)
TSCA
TSCA listed

Safety & regulation

Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.

Safety data

tsca
TSCA listed

Chemistry & industry

Uses & manufacturing

General Manufacturing Information4,7,10,13-Tetraazahexadecane-2,15-diol: INACTIVE

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Compound notes

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