Basic information
- Standard SMILES
CN(C)CCOCCO- InChIKey
YSAANLSYLSUVHB-UHFFFAOYSA-N- Molecular formula
- C6H15NO2
- Average molar mass
- 133.19 g/mol
- Monoisotopic mass
- 133.11027872
Names & identifiers
- Preferred name
- 2-(2-(Dimethylamino)ethoxy)ethanol
- IUPAC
- 2-[2-(dimethylamino)ethoxy]ethanol
- English name
- 2-[2-(Dimethylamino)ethoxy]ethanol
- Molecular formula
- C6H15NO2
- Molecular weight
- 133.19
Names & synonyms
Show more names
Database identifiers
- CAS
1704-62-7- PubChem CID
- 74348
- DTXSID
DTXSID1027427- ChEMBL
CHEMBL3188351- UNII
- C3YTX3O172
- EC Number
- 216-940-1
- Nikkaji
- J24.982C
Properties
Computed structural properties
- XLogP
- -0.6
- Topological polar surface area
- 32.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 5
- Heavy atoms
- 9
- Formal charge
- 0
- Complexity
- 57
Experimental & physicochemical properties
Physicochemical properties
- Boiling point
- 95 °C15 · 95 °C15 mm Hg(lit.)
- Density
- 0.954 g/mL · 0.954 g/mL at 25 °C(lit.)
- vapor pressure
- 11 Pa · 11Pa at 20℃
- refractive index
- 20 · n20/D 1.442(lit.)
- Flash point
- 199 °F · 199 °F
- storage temp.
- Inert atmosphere,Room Temperature
- solubility
- Chloroform (Slightly), Methanol (Slightly)
- form
- clear liquid
- pka
- 14.37 · 14.37±0.10(Predicted)
- color
- Colorless to Light yellow to Light orange
- Viscosity
- 11.7 mm2/s · 11.7mm2/s
- Water Solubility
- 1000 g/L · 1000g/L at 20℃
- Henry's Law Constant
- 8.3 · 8.3×102 mol/(m3Pa) at 25℃, Du et al. (2017)
- Stability
- Stable. Combustible. Incompatible with strong oxidizing agents, acids, isocyanates.
- InChI
- 1S/C6H15NO2/c1-7(2)3-5-9-6-4-8/h8H,3-6H2,1-2H3
- InChIKey
- YSAANLSYLSUVHB-UHFFFAOYSA-N
- SMILES
- CN(C)CCOCCO
- LogP
- -0.778 at · -0.778 at 20℃
- CAS DataBase Reference
- 1704 · 1704-62-7(CAS DataBase Reference)
- FDA UNII
- 3 YTX3O172 · C3YTX3O172
- NIST Chemistry Reference
- 2 · ethanol, 2-[2-(dimethylamino)ethoxy]-(1704-62-7)
- EPA Substance Registry System
- 2 · Ethanol, 2-[2-(dimethylamino)ethoxy]- (1704-62-7)
- UNSPSC Code
- 12162002 · 12162002
- NACRES
- 23 · NA.23
- Symbol(GHS)
- 5 · GHS05,GHS07
- Signal word
- Danger
- Hazard statements
- 312 · H312-H318
- Precautionary statements
- 280 · P280-P305+P351+P338
- PPE
- Eyeshields, Faceshields, Gloves, type ABEK (EN14387) respirator filter
- Hazard Codes
- Xn
- Risk Statements
- 21 · 21-41
- Safety Statements
- 26 · 26-36/37/39
- RIDADR
- 1993 · NA 1993 / PGIII
- WGK Germany
- 1 · 1
- RTECS
- 6825000 · KK6825000
- TSCA
- TSCA listed
- HS Code
- 29225090 · 29225090
- Storage Class
- 10 · 10 - Combustible liquids
- Hazard Classifications
- 4 DermalEye · Acute Tox. 4 DermalEye Dam. 1
- Toxicity
- 50 · rabbit,LD50,skin,1410uL/kg (1.41mL/kg),Toxicology and Applied Pharmacology. Vol. 28, Pg. 313, 1974.
- REACH Registrations
- Active
Safety & regulation
GHS classification
GHS Classification
Danger
H312 (90.7%): Harmful in contact with skin [Warning Acute toxicity, dermal]
P260, P264, P264+P265, P280, P301+P330+P331, P302+P352, P302+P361+P354, P304+P340, P305+P354+P338, P316, P317, P321, P362+P364, P363, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 257 reports by companies from 8 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Regulatory Information
Chemical: Ethanol, 2-[2-(dimethylamino)ethoxy]-
Ethanol, 2-[2-(dimethylamino)ethoxy]- is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of Ethanol, 2-[2-(dimethylamino)ethoxy]- are required to report information about their production and use of this chemical to the EPA under the Toxic Substances Control Act (TSCA). (40 eCFR Part 711)
Status: Active Update: 01-04-2023 https://echa.europa.eu/registration-dossier/-/registered-dossier/13345
Ethanol, 2-2-(dimethylamino)ethoxy-: Does not have an individual approval but may be used as a component in a product covered by a group standard. It is not approved for use as a chemical in its own right.
Safety data
- PPE
- Eyeshields, Faceshields, Gloves, type ABEK (EN14387) respirator filter
- wgk
- 1
- tsca
- TSCA listed
- rtecs
- KK6825000
- ridadr
- NA 1993 / PGIII
- hs_code
- 29225090
- Toxicity
- rabbit,LD50,skin,1410uL/kg (1.41mL/kg),Toxicology and Applied Pharmacology. Vol. 28, Pg. 313, 1974.
- risk_code
- 21-41
- Signal word
- Danger
- Symbol(GHS)
- GHS05,GHS07
- hazard_code
- Xn
- safety_code
- 26-36/37/39
- Storage Class
- 10 - Combustible liquids
- Hazard statements
- H312-H318
- REACH Registrations
- Active
- Hazard Classifications
- Acute Tox. 4 DermalEye Dam. 1
- Precautionary statements
- P280-P305+P351+P338
Chemistry & industry
Uses & manufacturing
General Manufacturing Information
Plastics Material and Resin Manufacturing
Ethanol, 2-[2-(dimethylamino)ethoxy]-: ACTIVE
Applications
UsesUsed for the preparation of low-density packaging foams.
Upstream & downstream products
Upstream raw materials
Downstream products
Suppliers50 total
Related reactions
Linked notes
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