Hexahydro-2H-azocine-1-ethylamine
Basic information
- CAS
1126-67-6- Standard SMILES
NCCN1CCCCCCC1- InChIKey
ZFGCHESRGLETHQ-UHFFFAOYSA-N- Molecular formula
- C9H20N2
- Average molar mass
- 156.27 g/mol
- Monoisotopic mass
- 156.16264865
Names & identifiers
- Preferred name
- Hexahydro-2H-azocine-1-ethylamine
- IUPAC
- 2-(azocan-1-yl)ethanamine
- English name
- hexahydro-2H-azocine-1-ethylamine
- Molecular formula
- C9H20N2
- Molecular weight
- 156.27
Names & synonyms
1126-67-6Hexahydro-2H-azocine-1-ethylamineEINECS 214-423-5DTXSID80150113RefChem:786138DTXCID9072604214-423-52-(azocan-1-yl)ethanamine2-(azocan-1-yl)ethan-1-amine1(2H)-Azocineethanamine,hexahydro-1(2H)-Azocineethanamine, hexahydro-MNW452GUD3
Show more names
2-(1-azocanyl)ethanamine2-(azocan-1-yl)ethylamineOctahydroazocine-1-ethanamineN-(B-AMINOETHYL)AZACYCLOOCTANEN-(BETA-AMINOETHYL)AZACYCLOOCTANE2-(1-azocanyl)ethanamine(SALTDATA: FREE)
SCHEMBL5143305ZFGCHESRGLETHQ-UHFFFAOYSA-NHexahydro-1(2H)-azocineethanamine2-(octahydro-1-azocinyl)-ethylamineDB-023677NS00023652EN300-2938663
Database identifiers
- CAS
1126-67-6- PubChem CID
- 70776
- DTXSID
DTXSID80150113- UNII
- MNW452GUD3
- EC Number
- 214-423-5
- Nikkaji
- J203.366F
Properties
Computed structural properties
- XLogP
- 1.3
- Topological polar surface area
- 29.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 85.6
Physicochemical properties
- Symbol(GHS)
- 5 · GHS05
- Signal word
- Danger
- Hazard statements
- 314 · H314
- Precautionary statements
- 260 · P260-P264-P280-P301+P330+P331-P303+P361+P353-P363-P304+P340-P310-P321-P305+P351+P338-P405-P501
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
H314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]
P260, P264, P280, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P321, P363, P405, and P501 (click each P-code to see the statement)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesSkin Corr. 1B (100%)
Safety data
- Signal word
- Danger
- Symbol(GHS)
- GHS05
- Hazard statements
- H314
- Precautionary statements
- P260-P264-P280-P301+P330+P331-P303+P361+P353-P363-P304+P340-P310-P321-P305+P351+P338-P405-P501
Chemistry & industry
Upstream & downstream products
Upstream raw materials
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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