1-Propanamine, N-ethyl-
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Basic information
- CAS
20193-20-8- Standard SMILES
CCCNCC- InChIKey
XCVNDBIXFPGMIW-UHFFFAOYSA-N- Molecular formula
- C5H13N
- Average molar mass
- 87.16 g/mol
- Monoisotopic mass
- 87.10479942
Names & identifiers
- Preferred name
- 1-Propanamine, N-ethyl-
- IUPAC
- N-ethylpropan-1-amine
- English name
- N-Ethylpropylamine
- Molecular formula
- C5H13N
- Molecular weight
- 87.16
Names & synonyms
N-Ethylpropylamine20193-20-81-Propanamine, N-ethyl-EthylpropylamineEINECS 243-573-4DTXSID2066565EC 243-573-4RefChem:435924DTXCID0036215243-573-4N-ethylpropan-1-amineethyl(propyl)amine
Show more names
3-AzahexaneN-Ethylpropylaminn-ethyl-1-propanamin
N-Ethyl-n-propylaminePropylamine, N-ethyl-ethyl-propyl-aminepropylethylamineMFCD00015198N-Ethylpropanamine; N-Ethylpropylamine; N-Propyl-N-ethylamineN-propylethylamineN-Ethylpropanamine
Database identifiers
- CAS
20193-20-8- PubChem CID
- 88398
- DTXSID
DTXSID2066565- EC Number
- 243-573-4
- Nikkaji
- J46.574G
Properties
Computed structural propertiesFilling in
- XLogP
- 1.1
- Topological polar surface area
- 12 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 3
- Heavy atoms
- 6
- Formal charge
- 0
- Complexity
- 19.9
Experimental & physicochemical properties
SpringerMaterials PropertiesDensity
Physicochemical properties
- Melting point
- -75 °C · -75°C (estimate)
- Boiling point
- 80 · 80-85°C
- Density
- 0 · 0,72 g/cm3
- vapor pressure
- 86 hPa · 86hPa at 20℃
- refractive index
- 1.395 · 1.3950-1.3980
- Flash point
- 80 · 80-85°C
- storage temp.
- Refrigerator
- solubility
- Chloroform, Ethyl Acetate
- pka
- 10.76 · 10.76±0.19(Predicted)
- form
- Liquid
- Specific Gravity
- 0.748 · 0.748
- color
- Colourless
- Henry's Law Constant
- 1.7 · 1.7×10-1 mol/(m3Pa) at 25℃, Yaws (2003)
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
Danger
H225 (100%): Highly Flammable liquid and vapor [Danger Flammable liquids]
P210, P233, P240, P241, P242, P243, P260, P261, P262, 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, P361+P364, P363, P370+P378, P403+P233, P403+P235, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 189 reports by companies from 9 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Regulatory InformationStatus: Active Update: 21-12-2022 https://echa.europa.eu/registration-dossier/-/registered-dossier/5403
Hazard Classes and CategoriesFlam. Liq. 2 (100%)
Safety data
- tsca
- TSCA listed
- ridadr
- 2735
- hs_code
- 2921.19.6190
- risk_code
- 34-11-37-35-24-20/22
- Signal word
- Danger
- Symbol(GHS)
- GHS02,GHS05
- hazard_code
- F,T,C
- safety_code
- 26-36/37/39-45-20
- hazard_class
- 3
- packing_group
- II
- Hazard statements
- H225-H314-H318
Chemistry & industry
Uses & manufacturing
General Manufacturing Information1-Propanamine, N-ethyl-: ACTIVE
Applications
UsesN-Ethylpropylamine is used in the synthesis of neuraminidase inhibitors as well as non-peptide CRF-1 antagonists.
Upstream & downstream products
Upstream raw materials
Related reactions
48 records
Compound notes
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