Basic information
- CAS
54879-88-8- Standard SMILES
COC(CNCc1ccccc1)OC- InChIKey
LODLUMZUJRFPLU-UHFFFAOYSA-N- Molecular formula
- C11H17NO2
- Average molar mass
- 195.26 g/mol
- Monoisotopic mass
- 195.12592878
Names & identifiers
- Preferred name
- N-Benzyl-2,2-dimethoxyethan-1-amine
- IUPAC
- N-benzyl-2,2-dimethoxyethanamine
- English name
- N-Benzyl-2,2-dimethoxyethanamine
- Molecular formula
- C11H17NO2
- Molecular weight
- 195.26
Names & synonyms
N-Benzyl-2,2-dimethoxyethan-1-amineDTXSID60970215RefChem:1091567DTXCID401397751n-benzyl-2,2-dimethoxyethanamine54879-88-8benzyl(2,2-dimethoxyethyl)amineBenzenemethanamine, N-(2,2-dimethoxyethyl)-MFCD00963826C11H17NO2N-Benzyl-2,2-dimethoxy-1-ethanamineNSC124714
Show more names
SCHEMBL3168512ZERENEX E/4048119N-benzyl-2,2-dimethoxy-ethanamine1-(3-chlorophenyl)-2-hydroxy-2-[(8-hydroxyquinolin-7-yl)amino]ethanoneAKOS001945382NSC-124714AS-61057N-(2,2-Dimethoxyethyl)benzenemethanamine
Database identifiers
- CAS
54879-88-8- PubChem CID
- 276572
- DTXSID
DTXSID60970215- EC Number
- 884-487-2
- Nikkaji
- J1.362.813K
Properties
Computed structural properties
- XLogP
- 1.2
- Topological polar surface area
- 30.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 6
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 131
Physicochemical properties
- Boiling point
- 102 °C · 102 °C(Press: 1 Torr)
- Density
- 1.008 · 1.008±0.06 g/cm3(Predicted)
- storage temp.
- 2 · 2-8°C, protect from light
- pka
- 7.3 · 7.30±0.29(Predicted)
- Appearance
- Colorless to light yellow Liquid
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 261 · P261-P280-P302+P352-P305+P351+P338
- HS Code
- 2922190090 · 2922190090
Safety & regulation
Safety data
- hs_code
- 2922190090
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P261-P280-P302+P352-P305+P351+P338
Chemistry & industry
Applications
UsesN-Benzyl-2,2-dimethoxyethanamine is used in the preparation of guanidylimidazole and guanidylimidazoline derivs. as antimalarial agents.
Upstream & downstream products
Downstream products
Suppliers29 total
上海毕得医药科技股份有限公司400-1647117 13681763483 · [email protected]
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
上海钰康生物科技有限公司+86-18930848214 +86-021-56762820 · [email protected]
湖北扬信医药科技有限公司0714-3999001 19171453112 · [email protected]
上海皓鸿生物医药科技有限公司400-8210725 4008210725 · [email protected]
Qingdao Dexin Chemical Co., Ltd+86-15553333686 · [email protected]
Labnetwork lnc.+86-27-50766799 +86-18062016861 · [email protected]
郑州为易化工产品有限公司0371-88888888 qq272369594;2159423853qq · [email protected]
上海昕凯医药科技有限公司21-619849051-1 18521059765 · [email protected]
淄博诚桥医化技术有限公司
Related reactions
1 records
Compound notes
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