Basic information
- CAS
125678-52-6- Standard SMILES
C#CCN(CC)CC- InChIKey
JZJXKEWVUBVOEH-UHFFFAOYSA-N- Molecular formula
- C7H13N
- Average molar mass
- 111.18 g/mol
- Monoisotopic mass
- 111.10479942
Names & identifiers
- Preferred name
- Dietylaminopropin
- IUPAC
- N,N-diethylprop-2-yn-1-amine
- English name
- N,N-Diethylpropargylamine
- Molecular formula
- C7H13N
- Molecular weight
- 111.18
Names & synonyms
Show more names
Database identifiers
- CAS
125678-52-6、4079-68-9- PubChem CID
- 20010
- DTXSID
DTXSID5063287- UNII
- 9X1BTC8Y1U
- EC Number
- 223-804-5、603-085-8
- Nikkaji
- J35.384A
Properties
Computed structural properties
- XLogP
- 1.1
- Topological polar surface area
- 3.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 3
- Heavy atoms
- 8
- Formal charge
- 0
- Complexity
- 83.8
Physicochemical properties
- Melting point
- 157 · 157-161°C
- Boiling point
- 118 · 118-120 °C(lit.)
- Density
- 0.8 g/mL · 0.80 g/mL at 20 °C(lit.)
- vapor pressure
- 14.6 hPa · 14.6hPa at 20℃
- refractive index
- 20 · n20/D 1.434
- Flash point
- 156 °C · 156°C
- storage temp.
- 2 · 2-8°C
- pka
- 8.54 · 8.54±0.25(Predicted)
- form
- clear liquid
- color
- Colorless to Light orange to Yellow
- Specific Gravity
- 0.811 · 0.811
- Water Solubility
- Soluble in acid. Insoluble in water.
- Sensitive
- Air & Light Sensitive
- BRN
- 1098468 · 1098468
- LogP
- 1.5 at · 1.5 at 23℃
- CAS DataBase Reference
- 4079 · 4079-68-9(CAS DataBase Reference)
- EWG's Food Scores
- 1 · 1
- FDA UNII
- 9 X1BTC8Y1U · 9X1BTC8Y1U
- NIST Chemistry Reference
- 2 · 2-Propyn-1-amine, n,n-diethyl-(4079-68-9)
- EPA Substance Registry System
- 2 · 2-Propyn-1-amine, N,N-diethyl- (4079-68-9)
- Symbol(GHS)
- 2 · GHS02,GHS05,GHS06
- Signal word
- Danger
- Hazard statements
- 225 · H225-H302-H311-H314-H318-H332
- Precautionary statements
- 210 · P210-P260h-P303+P361+P353-P305+P351+P338-P405-P501a
- Hazard Codes
- F,Xn,C,F+
- Risk Statements
- 11 · 11-21/22-34
- Safety Statements
- 26 · 26-36/37/39-45
- RIDADR
- 2733 · UN 2733 3/PG 2
- WGK Germany
- 3 · 3
- RTECS
- 5775000 · UK5775000
- F
- 8 · 8-10-13-23
- TSCA
- TSCA listed
- HazardClass
- 3 · 3
- PackingGroup
- I
- HS Code
- 29211990 · 29211990
- REACH Registrations
- Inactive
- Limited Quantities
- 1 L · 1.0 L (0.3 gallon) (liquid)
- Excepted Quantities
- Max Inner Pack (30g or 30ml) and Max Outer Pack (500g or 500ml)
Safety & regulation
GHS classification
GHS Classification
Danger
H225 (71.2%): Highly Flammable liquid and vapor [Danger Flammable liquids]
P210, P233, P240, P241, P242, P243, P260, P261, P262, P264, P264+P265, P270, P271, P273, P280, P301+P317, P301+P330+P331, P302+P352, P302+P361+P354, P303+P361+P353, P304+P340, P305+P351+P338, P305+P354+P338, P316, P317, P321, P330, P332+P317, P337+P317, P361+P364, 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 264 reports by companies from 15 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Regulatory Information
Chemical: 2-Propyn-1-amine, N,N-diethyl-
Status: Cease Manufacture Update: 05-09-2018 https://echa.europa.eu/registration-dossier/-/registered-dossier/23023
2-Propyn-1-amine, N,N-diethyl-: Does not have an individual approval but may be used under an appropriate group standard
Safety data
- F
- 8-10-13-23
- wgk
- 3
- tsca
- TSCA listed
- rtecs
- UK5775000
- ridadr
- UN 2733 3/PG 2
- hs_code
- 29211990
- risk_code
- 11-21/22-34
- Signal word
- Danger
- Symbol(GHS)
- GHS02,GHS05,GHS06
- hazard_code
- F,Xn,C,F+
- safety_code
- 26-36/37/39-45
- hazard_class
- 3
- packing_group
- I
- Hazard statements
- H225-H302-H311-H314-H318-H332
- Limited Quantities
- 1.0 L (0.3 gallon) (liquid)
- Excepted Quantities
- Max Inner Pack (30g or 30ml) and Max Outer Pack (500g or 500ml)
- REACH Registrations
- Inactive
- Precautionary statements
- P210-P260h-P303+P361+P353-P305+P351+P338-P405-P501a
Chemistry & industry
Uses & manufacturing
Applications
DescriptionN,N-Diethylpropargylamine is a kind of nickel plating brightener with excellent performance and excellent levelling effect. It is widely used in nickel plating and alloy plating industry, because it is insoluble in water, it is generally used after reacting with acid to form quaternary ammonium salt before use, meanwhile, it is also a kind of pharmaceutical intermediates and pesticide intermediates, and has certain application fields in fine chemical industry.
Uses3-Diethylamino-1-propyne is used as functional leveling agent, brightener.
Upstream & downstream products
Upstream raw materials
Suppliers100 total
Related reactions
Compound notes
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