2-Aminoindane
Basic information
- CAS
2975-41-9- Standard SMILES
NC1Cc2ccccc2C1- InChIKey
LMHHFZAXSANGGM-UHFFFAOYSA-N- Molecular formula
- C9H11N
- Average molar mass
- 133.19 g/mol
- Monoisotopic mass
- 133.08914935
Overview
RN given refers to parent cpd; structure
Names & identifiers
- Preferred name
- 2-Aminoindane
- IUPAC
- 2,3-dihydro-1H-inden-2-amine
- English name
- Indan-2-amine
- Molecular formula
- C9H11N
- Molecular weight
- 133.19
Names & synonyms
2-Aminoindan2975-41-92-AminoindaneIndan-2-amine1P810SQ3EYJ80.606DDTXSID40183902RefChem:85389DTXCID40106393221-021-32,3-dihydro-1H-inden-2-amine2-Indanamine
Show more names
2-AIPV-9Su-8629AKOS BC-0645AURORA KA-7507
INDAN-2-YLAMINE2-Amineindaneindane-2-ylamine1H-Inden-2-amine, 2,3-dihydro-2-indanylamine2,3-Dihydro-1H-inden-2-ylamineRasagiline Impurity 32(2,3-DIHYDRO-1H-INDEN-2-YL)AMINE
Database identifiers
- CAS
2975-41-9- PubChem CID
- 76310
- DTXSID
DTXSID40183902- ChEMBL
CHEMBL1188176- UNII
- 1P810SQ3EY
- EC Number
- 221-021-3
- Nikkaji
- J80.606D
Properties
Computed structural properties
- XLogP
- 1.7
- Topological polar surface area
- 26 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 0
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 108
Experimental & physicochemical properties
Drugs
DEA NFLIS-Drug Category -> Phenethylamines (Aminoindanes) (H)
Pharmaceuticals -> Synthetic Cannabinoids or Psychoactive Compounds
Physicochemical properties
- Melting point
- 33 · 33-34 °C
- Boiling point
- 103 · 103-105
- Density
- 1.024 g/mL · 1.024 g/mL at 25 °C(lit.)
- refractive index
- 20 · n20/D 1.561(lit.)
- Flash point
- 212 °F · 212 °F
- pka
- 9.21 · 9.21±0.20(Predicted)
- Water Solubility
- Slightly soluble in water.
- CAS DataBase Reference
- 2975 · 2975-41-9(CAS DataBase Reference)
- FDA UNII
- 1 P810SQ3EY · 1P810SQ3EY
- NIST Chemistry Reference
- 1 h-Inden-2-amine, · 1h-Inden-2-amine, 2,3-dihydro-(2975-41-9)
- Symbol(GHS)
- 5 · GHS05,GHS06
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
Warning
H315 (91.2%): Causes skin irritation [Warning Skin corrosion/irritation]
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 57 reports by companies from 6 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Hazard Classes and CategoriesSkin Irrit. 2 (91.2%)
Safety data
- wgk
- 3
- ridadr
- UN 2735 8/PG III
- risk_code
- 36/37/38-20/21/22
- Signal word
- Warning
- Symbol(GHS)
- GHS05,GHS06
- hazard_code
- Xi,C,Xn
- hazard_note
- Corrosive
- safety_code
- 26-36
- hazard_class
- 8
- packing_group
- III
- Hazard statements
- H301-H314-H318
- Limited Quantities
- 5.0 L (1.3 gallons) (liquid) or 5.0 kg (11 lbs) (solid)
- Excepted Quantities
- Max Inner Pack (30g or 30ml) and Max Outer Pack (1Kg or 1L)
- Precautionary statements
- P280-P305+P351+P338-P309-P310
Chemistry & industry
Applications
Uses2-Aminoindan is an analgesic with sympathomimetic activity. 2-Aminoindan is an inhibitor norepinephrine methyltransferase.
Uses2-Aminoindan is an analgesic with sympathomimetic activity, It is an inhibitor norepinephrine methyltransferase.
General Description2-Aminoindan (2-Aminoindane) is an analog of amphetamine. It shows a potential bronchodilator and analgesic effect. The impact of the intramolecular N-H···Π hydrogen bonding on the conformations of 2-Al has been analyzed.
Upstream & downstream products
Upstream raw materials
Downstream products
Related reactions
185 records
Compound notes
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