Basic information
- CAS
19355-69-2- Standard SMILES
CC(C)(N)C#N- InChIKey
JQULXIOYDDCNGR-UHFFFAOYSA-N- Molecular formula
- C4H8N2
- Average molar mass
- 84.12 g/mol
- Monoisotopic mass
- 84.06874826
Names & identifiers
- Preferred name
- 2-Amino-2-methylpropionitrile
- IUPAC
- 2-amino-2-methylpropanenitrile
- English name
- 2-AMINO-2-METHYL-PROPIONITRILE
- Molecular formula
- C4H8N2
- Molecular weight
- 84.12
Names & synonyms
Show more names
Database identifiers
- CAS
19355-69-2- PubChem CID
- 88022
- DTXSID
DTXSID0027804- ChEMBL
CHEMBL3188413- UNII
- KA4O623NBV
- EC Number
- 242-989-3
- Nikkaji
- J27.748G
Properties
Computed structural properties
- XLogP
- -0.3
- Topological polar surface area
- 49.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 0
- Heavy atoms
- 6
- Formal charge
- 0
- Complexity
- 85
Experimental & physicochemical properties
Physicochemical properties
- Boiling point
- 51 · 51-52 °C(Press: 15 Torr)
- Density
- 0.885 g/cm3 · 0.885 g/cm3(Temp: 25 °C)
- storage temp.
- -20 °C · Keep in dark place,Inert atmosphere,Store in freezer, under -20°C
- solubility
- DMSO (Sparingly), Methanol (Slightly)
- form
- Oil
- pka
- 5.06 · 5.06±0.25(Predicted)
- color
- Colourless to Pale Yellow
- CAS DataBase Reference
- 19355 · 19355-69-2(CAS DataBase Reference)
- EWG's Food Scores
- 1 · 1
- FDA UNII
- 4 O623NBV · KA4O623NBV
- EPA Substance Registry System
- 2 · Propanenitrile, 2-amino-2-methyl- (19355-69-2)
- Symbol(GHS)
- 5 · GHS05,GHS06
- Signal word
- Danger
- Hazard statements
- 301 · H301-H315-H317-H318-H335
- Precautionary statements
- 261 · P261-P280-P301+P310-P305+P351+P338
- Hazard Codes
- Xi,Xn
- Risk Statements
- 20 · 20/21/22-36/37/38-43-41-37/38-22
- Safety Statements
- 26 · 26-36/37/39-39-36/37
- RIDADR
- 3276 · 3276
- TSCA
- TSCA listed
- HazardClass
- IRRITANT
Safety & regulation
GHS classification
GHS Classification
Danger
H301+H311+H331 (33.3%): Toxic if swallowed, in contact with skin or if inhaled [Danger Acute toxicity, oral; acute toxicity, dermal; acute toxicity, inhalation]
P260, P261, P262, P264, P264+P265, P270, P271, P272, P280, P284, P301+P316, P301+P317, P302+P352, P304+P340, P305+P351+P338, P305+P354+P338, P316, P317, P319, P320, P321, P330, P332+P317, P333+P317, P337+P317, P361+P364, P362+P364, P403+P233, 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.
Hazard information
Regulatory Information
Propanenitrile, 2-amino-2-methyl- is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of Propanenitrile, 2-amino-2-methyl- 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)
Safety data
- tsca
- TSCA listed
- ridadr
- 3276
- risk_code
- 20/21/22-36/37/38-43-41-37/38-22
- Signal word
- Danger
- Symbol(GHS)
- GHS05,GHS06
- hazard_code
- Xi,Xn
- safety_code
- 26-36/37/39-39-36/37
- hazard_class
- IRRITANT
- Hazard statements
- H301-H315-H317-H318-H335
- Precautionary statements
- P261-P280-P301+P310-P305+P351+P338
Chemistry & industry
Uses & manufacturing
General Manufacturing Information
All Other Basic Organic Chemical Manufacturing
Propanenitrile, 2-amino-2-methyl-: ACTIVE
Applications
Uses2-AMINO-2-METHYL-PROPIONITRILE is used in the production of the insecticide acetamiprid and is also an intermediate in the production of the herbicide cyanamide.
Upstream & downstream products
Upstream raw materials
Downstream products
Suppliers72 total
Related reactions
Compound notes
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