Basic information
- CAS
16011-96-4- Standard SMILES
Cl.NC1=NCCCC1- InChIKey
ZHDTXTDHBRADLM-UHFFFAOYSA-N- Molecular formula
- C5H11ClN2
- Average molar mass
- 134.61 g/mol
- Monoisotopic mass
- 134.0610761
Names & identifiers
- Preferred name
- 2-Amino-3,4,5,6-tetrahydropyridine
- IUPAC
- 2,3,4,5-tetrahydropyridin-6-amine;hydrochloride
- English name
- 2-Iminopiperidine hydrochloride
- Molecular formula
- C5H11ClN2
- Molecular weight
- 134.61
Names & synonyms
2-Amino-3,4,5,6-tetrahydropyridine2-Pyridinamine, 3,4,5,6-tetrahydro-, hydrochloride (1:1)RefChem:463566240-146-42-Iminopiperidine hydrochloride16011-96-4piperidin-2-imine hydrochloride41419-55-02-Iminopiperidine, Hydrochloride2,3,4,5-tetrahydropyridin-6-amine;hydrochloridePiperidin-2-iminehydrochloridetetrahydropyridin-2(1H)-imine hydrochloride
Show more names
2-imino-piperidinhydrochloride2-Iminopiperidine hydrochloride 97%3,4,5,6-tetrahydropyridin-2-aMine hydrochloride3,4,5,6-Tetrahydro-2-pyridinamine hydrochloride2-AMINO-3,4,5,6-TETRAHYDROPYRIDINE HYDROCHLORIDE3,4,5,6-tetrahydro-2-pyridinaminmonohydrochloride
2-Iminopiperidine (hydrochloride)MFCD00006043Piperidine, 2-imino-, hydrochlorideEINECS 240-146-4Piperidine, 2-imino-, monohydrochloride2-Pyridinamine, 3,4,5,6-tetrahydro-, monohydrochloride2-Iminopiperidine HClorb3030073
Database identifiers
- CAS
16011-96-4- PubChem CID
- 85236
- DTXSID
DTXSID001377545- EC Number
- 240-146-4
Properties
Computed structural properties
- Topological polar surface area
- 38.4 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 0
- Heavy atoms
- 8
- Formal charge
- 0
- Complexity
- 86.1
Physicochemical properties
- Melting point
- 159 · 159-161 °C(lit.)
- storage temp.
- Store at RT
- solubility
- Methanol (Slightly), Water (Slightly)
- form
- Solid
- color
- White to Off-White
- InChI
- 1S/C5H10N2.ClH/c6-5-3-1-2-4-7-5;/h1-4H2,(H2,6,7);1H
- InChIKey
- ZHDTXTDHBRADLM-UHFFFAOYSA-N
- SMILES
- Cl.N=C1CCCCN1
- CAS DataBase Reference
- 16011 · 16011-96-4(CAS DataBase Reference)
- UNSPSC Code
- 12352100 · 12352100
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 315 · H315-H319-H335
- Precautionary statements
- 261 · P261-P305+P351+P338
- target organs
- Respiratory system
- Hazard Codes
- Xi
- Risk Statements
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 (100%): 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 42 reports by companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Hazard Classes and CategoriesSkin Irrit. 2 (100%)
Safety data
- wgk
- 3
- rtecs
- TN0404000
- hs_code
- 2933399990
- risk_code
- 36/37/38
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- Xi
- safety_code
- 26
- Storage Class
- 11 - Combustible Solids
- target organs
- Respiratory system
- Hazard statements
- H315-H319-H335
- Hazard Classifications
- Eye Irrit. 2Skin Irrit. 2STOT SE 3
- Precautionary statements
- P261-P305+P351+P338
Chemistry & industry
Applications
UsesReactant for synthesis of: heteroaromatic compound from alkenes using ketoiodination-cyclization protocols1 HIV-1 integrase inhibitor scaffolds2 Fluorinated bicyclic heterocycles3Reactant for: Diels-Alder reactions of heterocyclic azadienes4 Condensation reactions5
UsesA potent inhibitor of NOS isoforms.
UsesReactant for synthesis of: heteroaromatic compound from alkenes using ketoiodination-cyclization protocols HIV-1 integrase inhibitor scaffolds Fluorinated bicyclic heterocyclesReactant for: Diels-Alder reactions of heterocyclic azadienes Condensation reactions
Suppliers18 total
Career Henan Chemica Co+86-0371-86658258 +86-13203830695 · [email protected]
陕西缔都新材料有限公司029-63373950 17392216152 · [email protected]
Aladdin Scientific[email protected]
Syntechem Co.,Ltd[email protected]
武汉易泰科技有限公司上海分公司18930552037 · [email protected]
上海瀚鸿科技股份有限公司021-54306202 13764082696 · [email protected]
MedBio脉铂医药021-69568360 18916172912 · [email protected]
江苏艾康生物医药研发有限公司025-66028182 17714375163 · [email protected]
Sigma-Aldrich西格玛奥德里奇(上海)贸易有限公司021-61415566 800-8193336 · [email protected]
Related reactions
2 records
Compound notes
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