3-(tert-Butoxy)propylamine hydrochloride
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Basic information
- CAS
864658-14-0- Standard SMILES
CC(C)(C)OCCCN.Cl- InChIKey
PWSZRKJMCDQAOY-UHFFFAOYSA-N- Molecular formula
- C7H18ClNO
- Average molar mass
- 167.68 g/mol
- Monoisotopic mass
- 167.1076919
Names & identifiers
- Preferred name
- 3-(tert-Butoxy)propylamine hydrochloride
- IUPAC
- 3-[(2-methylpropan-2-yl)oxy]propan-1-amine;hydrochloride
- English name
- NH2-PR-OTBU HCL
- Molecular formula
- C7H18ClNO
- Molecular weight
- 167.68
Names & synonyms
864658-14-0NH2-PR-OTBU HCL3-(tert-Butoxy)propylamine hydrochloride3-(tert-Butoxy)propylamine.HClNH2-PR-OTBUHCL3-(TERT-BUTOXY)PROPAN-1-AMINE HYDROCHLORIDEMFCD049731923-[(2-methylpropan-2-yl)oxy]propan-1-amine;hydrochloride3-(TERT-BUTOXY)PROPYLAMINE HCL3-(T-BUTYLOXY)-PROPYLAMINE HYDROCHLORIDESCHEMBL4287657DTXSID30694537
Show more names
3-(TERT-BUTYLOXY)-PROPYLAMINE HYDROCHLORIDE3-Aminopropyl tert-butyl ether hydrochloride3-[(2-methylpropan-2-yl)oxy]propan-1-amine,hydrochloride3-(tert-Butoxy)propylamine·HCl≥ 97% (Assay by Titration)
PWSZRKJMCDQAOY-UHFFFAOYSA-N3-tert-butoxypropylamine hydrochloride3-tert-butoxypropan-1-amine;hydrochlorideCS-02728823-(tert-Butoxy)propylamine hydrochloride, 97%EN300-299955G844853-tert-Butoxypropan-1-amine--hydrogen chloride (1/1)
Database identifiers
- CAS
864658-14-0- PubChem CID
- 53399017
- DTXSID
DTXSID30694537
Properties
Computed structural propertiesFilling in
- Topological polar surface area
- 35.3 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 4
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 65.8
Physicochemical properties
- Melting point
- 121 · 121-123°C
- storage temp.
- 2 · 2-8°C
- form
- powder
- InChI
- 1S/C7H17NO.ClH/c1-7(2,3)9-6-4-5-8;/h4-6,8H2,1-3H3;1H
- InChIKey
- PWSZRKJMCDQAOY-UHFFFAOYSA-N
- SMILES
- Cl.CC(C)(C)OCCCN
- UNSPSC Code
- 12352100 · 12352100
- PPE
- Eyeshields, Gloves
- Risk Statements
- 36 · 36/37/38
- Safety Statements
- 26 · 26-36/37/39
- WGK Germany
- 3 · 3
- HS Code
- 2922190090 · 2922190090
- Storage Class
- 10 · 10 - Combustible liquids
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- PPE
- Eyeshields, Gloves
- wgk
- 3
- hs_code
- 2922190090
- risk_code
- 36/37/38
- safety_code
- 26-36/37/39
- Storage Class
- 10 - Combustible liquids
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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