Basic information
- CAS
2978-45-2- Standard SMILES
C=CC(C)(C)NC(C)(C)CC- InChIKey
BMDISKTZXDELHS-UHFFFAOYSA-N- Molecular formula
- C10H21N
- Average molar mass
- 155.28 g/mol
- Monoisotopic mass
- 155.16739967
Names & identifiers
- Preferred name
- N-tert-Amyl-1,1-dimethylallylamine
- IUPAC
- 2-methyl-N-(2-methylbut-3-en-2-yl)butan-2-amine
- English name
- N-TERT-AMYL-1 1-DIMETHYLALLYLAMINE 97
- Molecular formula
- C10H21N
- Molecular weight
- 155.28
Names & synonyms
N-tert-Amyl-1,1-dimethylallylamine2978-45-2DTXSID80395108RefChem:364922DTXCID40345967631-105-52-Methyl-N-(tert-pentyl)but-3-en-2-amine2-methyl-N-(2-methylbut-3-en-2-yl)butan-2-aminestarbld0045409SCHEMBL4797202-methyl-N-(2-methylbutan-2-yl)but-3-en-2-aminebutane, 2-methyl-2-(1,1-dimethylallyl)amino-
Show more names
N-TERT-AMYL-1 1-DIMETHYLALLYLAMINE 973-Buten-2-amine, N-(1,1-dimethylpropyl)-2-methyl-
N-TERT-AMYL-1,1-DIMETHYLALLYLAMINE, 97%
Database identifiers
- CAS
2978-45-2- PubChem CID
- 3691229
- DTXSID
DTXSID80395108- EC Number
- 631-105-5
Properties
Computed structural properties
- XLogP
- 2.5
- Topological polar surface area
- 12 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 4
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 134
Physicochemical properties
- Boiling point
- 168 °C · 168 °C(lit.)
- Density
- 0.793 g/mL · 0.793 g/mL at 25 °C(lit.)
- refractive index
- 20 · n20/D 1.4395(lit.)
- Flash point
- 105 °F · 105 °F
- pka
- 10.09 · 10.09±0.48(Predicted)
- Symbol(GHS)
- 2 · GHS02,GHS05
- Signal word
- Danger
- Hazard statements
- 314 · H314-H226
- Precautionary statements
- 260 · P260-P264-P280-P301+P330+P331-P303+P361+P353-P363-P304+P340-P310-P321-P305+P351+P338-P405-P501
- Hazard Codes
- C
- Risk Statements
- 10 · 10-34
- Safety Statements
- 26 · 26-36/37/39-45
- RIDADR
- 2733 · UN 2733 3/PG 3
- WGK Germany
- 3 · 3
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
H226 (100%): Flammable liquid and vapor [Warning Flammable liquids]
P210, P233, P240, P241, P242, P243, P260, P264, P280, P301+P330+P331, P302+P361+P354, P303+P361+P353, P304+P340, P305+P354+P338, P316, P321, P363, P370+P378, P403+P235, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 39 reports by companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Hazard Classes and CategoriesFlam. Liq. 3 (100%)
Safety data
- wgk
- 3
- ridadr
- UN 2733 3/PG 3
- risk_code
- 10-34
- Signal word
- Danger
- Symbol(GHS)
- GHS02,GHS05
- hazard_code
- C
- safety_code
- 26-36/37/39-45
- Hazard statements
- H314-H226
- Precautionary statements
- P260-P264-P280-P301+P330+P331-P303+P361+P353-P363-P304+P340-P310-P321-P305+P351+P338-P405-P501
Chemistry & industry
Suppliers1 total
安耐吉化学&3A（安徽泽升科技股份有限公司）400-0056266 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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