Basic information
- CAS
22990-77-8- Standard SMILES
NCC1CCCCN1- InChIKey
RHPBLLCTOLJFPH-UHFFFAOYSA-N- Molecular formula
- C6H14N2
- Average molar mass
- 114.19 g/mol
- Monoisotopic mass
- 114.11569845
Overview
2-Piperidinemethanamine is a member of piperidines.
Names & identifiers
- Preferred name
- Piperidine-2-methylamine
- IUPAC
- piperidin-2-ylmethanamine
- English name
- 2-PIPERIDYLMETHYLAMINE
- Molecular formula
- C6H14N2
- Molecular weight
- 114.19
Names & synonyms
Show more names
Database identifiers
- CAS
22990-77-8- PubChem CID
- 90865
- DTXSID
DTXSID80945687- ChEBI
CHEBI:229435- UNII
- 9Y4RLA45BH
- EC Number
- 245-371-1
- Nikkaji
- J43.049H
Properties
Computed structural properties
- XLogP
- -0.2
- Topological polar surface area
- 38.1 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 8
- Formal charge
- 0
- Complexity
- 63.5
Physicochemical properties
- Boiling point
- 63 · 63-66°C/12mm
- Density
- 0.9406 g/mL · 0.9406 g/mL at 25 °C
- refractive index
- 1.485 · 1.4850
- Flash point
- 63 · 63-66°C/12mm
- storage temp.
- -20 °C · -20°C
- solubility
- Chloroform (Slightly), Ethyl Acetate (Slightly), Methanol (Slightly)
- pka
- 10.32 · 10.32±0.29(Predicted)
- color
- Clear Colorless
- BRN
- 102994 · 102994
- InChI
- InChI=1S/C6H14N2/c7-5-6-3-1-2-4-8-6/h6,8H,1-5,7H2
- InChIKey
- RHPBLLCTOLJFPH-UHFFFAOYSA-N
- SMILES
- N1CCCCC1CN
- CAS DataBase Reference
- 22990 · 22990-77-8(CAS DataBase Reference)
- FDA UNII
- 9 Y4RLA45BH · 9Y4RLA45BH
- UNSPSC Code
- 41116107 · 41116107
- NACRES
- 24 · NA.24
- Symbol(GHS)
- 5 · GHS05
- Signal word
- Danger
- Hazard statements
- 314 · H314
- Precautionary statements
- 280 · P280-P303+P361+P353-P304+P340+P310-P305+P351+P338-P363-P405
- PPE
- Faceshields, Gloves, Goggles, type ABEK (EN14387) respirator filter
- Hazard Codes
- C
- Risk Statements
- 34 · 34
- Safety Statements
- 26 · 26-36/37/39-45
- RIDADR
- 2735 · 2735
- WGK Germany
- 2 · 2
- HazardClass
- 8 · 8
- PackingGroup
- III
- HS Code
- 29333990 · 29333990
- Storage Class
- 8 A · 8A - Combustible corrosive hazardous materials
- Hazard Classifications
- 1 B · Skin Corr. 1B
- REACH Registrations
- Active
- Limited Quantities
- 1 L · 1.0 L (0.3 gallons) (liquid) or 1 Kg (2.2 lbs) (solid)
- Excepted Quantities
- Max Inner Pack (30g or 30ml) and Max Outer Pack (500g or 500ml)
Safety & regulation
GHS classification
GHS Classification
Danger
H302 (65.5%): Harmful if swallowed [Warning Acute toxicity, oral]
P260, P264, P264+P265, P270, P280, P301+P317, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P317, P321, P330, P363, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 168 reports by companies from 8 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Safety data
- PPE
- Faceshields, Gloves, Goggles, type ABEK (EN14387) respirator filter
- wgk
- 2
- ridadr
- 2735
- hs_code
- 29333990
- risk_code
- 34
- Signal word
- Danger
- Symbol(GHS)
- GHS05
- hazard_code
- C
- safety_code
- 26-36/37/39-45
- hazard_class
- 8
- Storage Class
- 8A - Combustible corrosive hazardous materials
- packing_group
- III
- Hazard statements
- H314
- Limited Quantities
- 1.0 L (0.3 gallons) (liquid) or 1 Kg (2.2 lbs) (solid)
- Excepted Quantities
- Max Inner Pack (30g or 30ml) and Max Outer Pack (500g or 500ml)
- REACH Registrations
- Active
- Hazard Classifications
- Skin Corr. 1B
- Precautionary statements
- P280-P303+P361+P353-P304+P340+P310-P305+P351+P338-P363-P405
Chemistry & industry
Applications
UsesReactant for reversible aminal formationReactant for synthesis of:Annulated N-heterocyclic carbene ligandsM3 Muscarinic receptor antagonistsSelective 5-ht5A receptor antagonistsTernary platinum(II) complexes
Uses2-Piperidinemethanamine is used in the synthesis of compounds exhibiting anti-osteoclast and anti-osteoblast activity. It also is used in the synthesis of potent antibacterial.
Upstream & downstream products
Upstream raw materials
Downstream products
Suppliers100 total
Related reactions
Compound notes
Loading…