4-(aminomethyl)-N,N,1-trimethylpiperidin-4-amine
Basic information
- CAS
876717-12-3- Standard SMILES
CN1CCC(CN)(N(C)C)CC1- InChIKey
YLOZCKVJAIJJEJ-UHFFFAOYSA-N- Molecular formula
- C9H21N3
- Average molar mass
- 171.28 g/mol
- Monoisotopic mass
- 171.17354768
Names & identifiers
- Preferred name
- 4-(aminomethyl)-N,N,1-trimethylpiperidin-4-amine
- IUPAC
- 4-(aminomethyl)-N,N,1-trimethylpiperidin-4-amine
- English name
- 4-(aminomethyl)-N,N,1-trimethylpiperidin-4-amine
- Molecular formula
- C9H21N3
- Molecular weight
- 171.28
Names & synonyms
4-(aminomethyl)-N,N,1-trimethylpiperidin-4-amine876717-12-3DTXSID30424417RefChem:288459DTXCID10375251(4-Aminomethyl-1-methyl-piperidin-4-yl)-dimethyl-amineMFCD052017171359AF4-Piperidinemethanamine,4-(dimethylamino)-1-methyl-SCHEMBL1956611ALBB-000074AKOS000186851
Show more names
4-(DiMethylaMino)-1-Methyl-4-piperidineMethanaMine4-Piperidinemethanamine, 4-(dimethylamino)-1-methyl-4-(aminomethyl)-N,N,1-trimethylpiperidin-4-amine(SALTDATA: FREE)
SB41370DA-22228NS-01405SY081943CS-0232142ST50289561H20745EN300-1263758
Database identifiers
- CAS
876717-12-3- PubChem CID
- 6484201
- DTXSID
DTXSID30424417- EC Number
- 990-200-2
Properties
Computed structural properties
- XLogP
- -0.3
- Topological polar surface area
- 32.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 137
Physicochemical properties
- form
- solid
- InChI
- 1S/C9H21N3/c1-11(2)9(8-10)4-6-12(3)7-5-9/h4-8,10H2,1-3H3
- InChIKey
- YLOZCKVJAIJJEJ-UHFFFAOYSA-N
- SMILES
- CN(C)C1(CN)CCN(C)CC1
- UNSPSC Code
- 12352116 · 12352116
- NACRES
- 21 · NA.21
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 280 · P280-P305+P351+P338
- WGK Germany
- 3 · 3
- Storage Class
- 11 · 11 - Combustible Solids
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, P261, P264, P271, P280, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P319, P321, P363, P403+P233, 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
- wgk
- 3
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Storage Class
- 11 - Combustible Solids
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P280-P305+P351+P338
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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