Basic information
- CAS
5754-35-8- Standard SMILES
NCCC1OCCO1- InChIKey
JNAQYWWCTUEVKR-UHFFFAOYSA-N- Molecular formula
- C5H11NO2
- Average molar mass
- 117.15 g/mol
- Monoisotopic mass
- 117.07897859
Names & identifiers
- Preferred name
- 1,3-Dioxolane-2-ethylamine
- IUPAC
- 2-(1,3-dioxolan-2-yl)ethanamine
- English name
- 2-(2-AMINOETHYL)-1,3-DIOXOLANE
- Molecular formula
- C5H11NO2
- Molecular weight
- 117.15
Names & synonyms
Show more names
Database identifiers
- CAS
5754-35-8- PubChem CID
- 79827
- DTXSID
DTXSID70206158- EC Number
- 227-277-2
- Nikkaji
- J38.311B
Properties
Computed structural properties
- XLogP
- -0.7
- Topological polar surface area
- 44.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 8
- Formal charge
- 0
- Complexity
- 61
Physicochemical properties
- Boiling point
- 75 °C · 75 °C / 18mmHg
- Density
- 1 · 1,07 g/cm3
- refractive index
- 1.451 · 1.4510-1.4540
- storage temp.
- 2 · Keep in dark place,Sealed in dry,2-8°C
- solubility
- Dichloromethane, Methanol
- form
- Oil
- pka
- 10.33 · 10.33±0.10(Predicted)
- color
- Yellow
- InChI
- InChI=1S/C5H11NO2/c6-2-1-5-7-3-4-8-5/h5H,1-4,6H2
- InChIKey
- JNAQYWWCTUEVKR-UHFFFAOYSA-N
- SMILES
- O1CCOC1CCN
- CAS DataBase Reference
- 5754 · 5754-35-8(CAS DataBase Reference)
- Symbol(GHS)
- 2 · GHS02,GHS05
- Signal word
- Danger
- Hazard statements
- 226 · H226-H314
- Precautionary statements
- 210 · P210-P233-P240-P241+P242+P243-P260-P264-P280-P301+P330+P331+P310-P303+P361+P353+P310+P363-P304+P340+P310-P305+P351+P338+P310-P370+P378-P403+P235-P405-P501
- Hazard Codes
- Xn
- Risk Statements
- 11 · 11-36/37/38-41-37/38-22
- Safety Statements
- 16 · 16-26-36/37/39-39
- RIDADR
- 1993 · 1993
- HS Code
- 2932.99 · 2932.99.9090
- HazardClass
- 3 · 3/8
- PackingGroup
- III
Safety & regulation
GHS classification
GHS Classification
Danger
H226 (66.7%): Flammable liquid and vapor [Warning Flammable liquids];H302 (66.7%): Harmful if swallowed [Warning Acute toxicity, oral];H314 (66.7%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation];H315 (33.3%): Causes skin irritation [Warning Skin corrosion/irritation];H318 (66.7%): Causes serious eye damage [Danger Serious eye damage/eye irritation];H335 (66.7%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]
P210, P233, P240, P241, P242, P243, P260, P261, P264, P264+P265, P270, P271, P280, P301+P317, P301+P330+P331, P302+P352, P302+P361+P354, P303+P361+P353, P304+P340, P305+P354+P338, P316, P317, P319, P321, P330, P332+P317, P362+P364, P363, P370+P378, P403+P233, P403+P235, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 3 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.;Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.
Hazard information
Safety data
- ridadr
- 1993
- hs_code
- 2932.99.9090
- risk_code
- 11-36/37/38-41-37/38-22
- Signal word
- Danger
- Symbol(GHS)
- GHS02,GHS05
- hazard_code
- Xn
- safety_code
- 16-26-36/37/39-39
- hazard_class
- 3/8
- packing_group
- III
- Hazard statements
- H226-H314
- Precautionary statements
- P210-P233-P240-P241+P242+P243-P260-P264-P280-P301+P330+P331+P310-P303+P361+P353+P310+P363-P304+P340+P310-P305+P351+P338+P310-P370+P378-P403+P235-P405-P501
Chemistry & industry
Suppliers53 total
Related reactions
Compound notes
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