Basic information
- CAS
86770-74-3- Standard SMILES
NCCOCCOCCOCCO- InChIKey
ANOJXMUSDYSKET-UHFFFAOYSA-N- Molecular formula
- C8H19NO4
- Average molar mass
- 193.24 g/mol
- Monoisotopic mass
- 193.13140809
Names & identifiers
- Preferred name
- Ethanol, 2-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]-
- IUPAC
- 2-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]ethanol
- English name
- 1-AMINO-3,6,9-TRIOXAUNDECANYL-11-OL
- Molecular formula
- C8H19NO4
- Molecular weight
- 193.24
Names & synonyms
86770-74-32-(2-(2-(2-Aminoethoxy)ethoxy)ethoxy)ethanolTetraethylene glycol monoamine2-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]ethanolT4EGMAEthanol, 2-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]-2-{2-[2-(2-aminoethoxy)ethoxy]ethoxy}ethan-1-ol2-(2-(2-(2-aminoethoxy)ethoxy)ethoxy)ethan-1-olEthanol, 2-(2-(2-(2-aminoethoxy)ethoxy)ethoxy)-DTXSID50729332-{2-[2-(2-aminoethoxy)ethoxy]ethoxy}ethanol2-[2-(2-[2-aminoethoxy]ethoxy)ethoxy]ethanol
Show more names
NH2-PEG4-OHNH2-PEG4Amino-dPEG(R)4-OHH2N-dPEG4)-OHAmino-PEG3-ol
RefChem:592167DTXCID2048537846-679-4Amino-PEG4-alcohol1-Amino-3,6,9-Trioxaundecanyl-11-olH2N-PEG4-OHMFCD01752874C8H19NO4
Database identifiers
- CAS
86770-74-3- PubChem CID
- 160103
- DTXSID
Properties
Computed structural properties
- XLogP
- -1.8
- Topological polar surface area
- 73.9 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 10
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 92.2
Physicochemical properties
- Boiling point
- 301.6 · 301.6±27.0 °C(Predicted)
- Density
- 1.068 · 1.068±0.06 g/cm3(Predicted)
- storage temp.
- -20 °C · -20°C
- solubility
- Chloroform (Slightly), Methanol (Slightly)
- pka
- 14.36 · 14.36±0.10(Predicted)
- form
- solid or viscous liquid
- color
- Colourless to Dark Brown
- Appearance
- colorless to yellowish oil
- Water Solubility
- 50 mg/mL · Water: 50 mg/mL (258.75 mM)
- InChI
- InChI=1S/C8H19NO4/c9-1-3-11-5-7-13-8-6-12-4-2-10/h10H,1-9H2
- InChIKey
- ANOJXMUSDYSKET-UHFFFAOYSA-N
- SMILES
- C(O)COCCOCCOCCN
- CAS DataBase Reference
- 86770 · 86770-74-3
- EPA Substance Registry System
- 2 · Ethanol, 2-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]- (86770-74-3)
- UNSPSC Code
Safety & regulation
GHS classification
GHS Classification
Danger
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P354+P338, P317, P319, P321, P332+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Hazard information
Regulatory InformationPMN - indicates a commenced PMN (Pre-Manufacture Notices) substance.
Hazard Classes and CategoriesSkin Irrit. 2 (100%)
Safety data
- wgk
- WGK 3
- tsca
- TSCA listed
- hs_code
- 2922190090
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Storage Class
- 11 - Combustible Solids
- Hazard statements
- H315-H319-H335
- Precautionary statements
- P261-P305+P351+P338
Chemistry & industry
Uses & manufacturing
General Manufacturing InformationEthanol, 2-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]-: ACTIVE
Applications
DescriptionAmino-PEG4-alcohol is a very popular PEG reagent containing an amino group (NH2) with a hydroxyl group (OH). The amino group is reactive with carboxylic acids, activated NHS esters, carbonyls (ketone, aldehyde) etc. The hydroxyl group enables further derivatization or replacement with other reactive functional groups.
Uses1-Amino-3,6,9-trioxaundecanyl-11-ol can be used in a test kit to detect progesterone.
Upstream & downstream products
Upstream raw materials
Related reactions
10 records
Compound notes
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