Basic information
- CAS
627-37-2- Standard SMILES
C=CCNC- InChIKey
IOXXVNYDGIXMIP-UHFFFAOYSA-N- Molecular formula
- C4H9N
- Average molar mass
- 71.12 g/mol
- Monoisotopic mass
- 71.07349929
Names & identifiers
- Preferred name
- N-Methylallylamine
- IUPAC
- N-methylprop-2-en-1-amine
- English name
- N-Allylmethylamine
- Molecular formula
- C4H9N
- Molecular weight
- 71.12
Names & synonyms
Show more names
Database identifiers
- CAS
627-37-2- PubChem CID
- 69391
- DTXSID
DTXSID8073219- ChEMBL
CHEMBL3558338- UNII
- JXA5N62PYD
- EC Number
- 210-996-0
- Nikkaji
- J514B
Properties
Computed structural properties
- XLogP
- 0.4
- Topological polar surface area
- 12 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 2
- Heavy atoms
- 5
- Formal charge
- 0
- Complexity
- 24.8
Experimental & physicochemical properties
Physicochemical properties
- Boiling point
- 64 · 64-66 °C(lit.)
- Density
- 0.741 g/mL · 0.741 g/mL at 25 °C(lit.)
- refractive index
- 20 · n20/D 1.412(lit.)
- Flash point
- 19 °F · −19 °F
- storage temp.
- 2 · 2-8°C
- pka
- 9.88 · 9.88±0.10(Predicted)
- form
- liquid
- color
- Clear, pale yellow
- Water Solubility
- Miscible with water.
- BRN
- 1098387 · 1098387
- InChI
- InChI=1S/C4H9N/c1-3-4-5-2/h3,5H,1,4H2,2H3
- InChIKey
- IOXXVNYDGIXMIP-UHFFFAOYSA-N
- SMILES
- C(NC)C=C
- EWG's Food Scores
- 1 · 1
- NIST Chemistry Reference
- 2 · CH2=CHCH2NHCH3(627-37-2)
- EPA Substance Registry System
- 2 · 2-Propen-1-amine, N-methyl- (627-37-2)
- UNSPSC Code
- 12352100 · 12352100
- NACRES
- 22 · NA.22
- Symbol(GHS)
- 2 · GHS02,GHS05,GHS06
- Signal word
- Danger
- Hazard statements
- 225 · H225-H301+H311+H331-H314
- Precautionary statements
- 210 · P210-P233-P280-P303+P361+P353-P304+P340+P310-P305+P351+P338
- PPE
- Faceshields, Gloves, Goggles, type ABEK (EN14387) respirator filter
- Hazard Codes
- F,T
- Risk Statements
- 11 · 11-23/24/25-34
- Safety Statements
- 26 · 26-36/37/39-45-37/39
- RIDADR
- 3286 · UN 3286 3/PG 2
- WGK Germany
- 3 · 3
- RTECS
- 6632500 · UC6632500
- F
- 9 · 9-34
- HazardClass
- 3 · 3
- PackingGroup
- II
- HS Code
- 29211990 · 29211990
- Storage Class
- 3 · 3 - Flammable liquids
- Hazard Classifications
- 3 OralFlam · Acute Tox. 3 OralFlam. Liq. 2Skin Corr. 1B
- 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 (100%): Highly Flammable liquid and vapor [Danger Flammable liquids]
P210, P233, P240, P241, P242, P243, P260, P261, P262, P264, P270, P271, P280, P301+P316, P301+P330+P331, P302+P352, P302+P361+P354, P303+P361+P353, P304+P340, P305+P354+P338, P316, 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 47 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Safety data
- F
- 9-34
- PPE
- Faceshields, Gloves, Goggles, type ABEK (EN14387) respirator filter
- wgk
- 3
- rtecs
- UC6632500
- ridadr
- UN 3286 3/PG 2
- hs_code
- 29211990
- risk_code
- 11-23/24/25-34
- Signal word
- Danger
- Symbol(GHS)
- GHS02,GHS05,GHS06
- hazard_code
- F,T
- safety_code
- 26-36/37/39-45-37/39
- hazard_class
- 3
- Storage Class
- 3 - Flammable liquids
- packing_group
- II
- Hazard statements
- H225-H301+H311+H331-H314
- Limited Quantities
- 1.0 L (0.3 gallon) (liquid)
- Excepted Quantities
- Max Inner Pack (30g or 30ml) and Max Outer Pack (500g or 500ml)
- Hazard Classifications
- Acute Tox. 3 OralFlam. Liq. 2Skin Corr. 1B
- Precautionary statements
- P210-P233-P280-P303+P361+P353-P304+P340+P310-P305+P351+P338
Chemistry & industry
Applications
UsesN-Allylmethylamine is used in the production of N-allyl-alfa,alfa-dichloro-N-methylacetamide. It is used as a functional monomer to coordinate with Cd(II)/Zn(II) ions to get the poly methyl methacrylate -butyl methacrylate - N-allylmethylamine (PMBA) films, which is useful as building blocks to fabricate a photo-catalytic cell.
Upstream & downstream products
Upstream raw materials
Downstream products
Suppliers100 total
Related reactions
Compound notes
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