Basic information
- CAS
39650-82-3- Standard SMILES
COC1(OC)CCCN1C- InChIKey
IWVFFVBJTCPIIG-UHFFFAOYSA-N- Molecular formula
- C7H15NO2
- Average molar mass
- 145.2 g/mol
- Monoisotopic mass
- 145.11027872
Names & identifiers
- Preferred name
- 2,2-Dimethoxy-1-methylpyrrolidine
- IUPAC
- 2,2-dimethoxy-1-methylpyrrolidine
- English name
- 2,2-diMethoxy-1-Methyl-Pyrrolidine
- Molecular formula
- C7H15NO2
- Molecular weight
- 145.2
Names & synonyms
2,2-dimethoxy-1-methylpyrrolidineRefChem:441195832-957-239650-82-3Pyrrolidine, 2,2-dimethoxy-1-methyl-N-methyl-2-pyrrolidone dimethyl acetalSCHEMBL5915754DTXSID30454158IWVFFVBJTCPIIG-UHFFFAOYSA-NPBA65082EN300-1189862,2-diMethoxy-1-Methyl-Pyrrolidine
Database identifiers
- CAS
39650-82-3- PubChem CID
- 11073552
- DTXSID
DTXSID30454158- EC Number
- 832-957-2
Properties
Computed structural properties
- XLogP
- 0.5
- Topological polar surface area
- 21.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 112
Physicochemical properties
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H335-H319-H315
- Precautionary statements
- 264 · P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P-P264-P270-P301+P312-P330-P501
Safety & regulation
GHS classification
GHS Classification
Warning
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]；H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, 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 CategoriesAcute Tox. 4 (100%)；Skin Irrit. 2 (100%)；Eye Irrit. 2A (100%)；STOT SE 3 (100%)
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H335-H319-H315
- Precautionary statements
- P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P-P264-P270-P301+P312-P330-P501
Chemistry & industry
Suppliers5 total
上海烁点生物科技有限公司18221553137
江苏艾康生物医药研发有限公司025-58851090 13913916777 · [email protected]
济南尚博生物科技有限公司+8615866703830 · [email protected]
上海普黎康化工科技有限公司021-54321516 17717324060 · [email protected]
河北药成医药科技有限责任公司19903117580 19903117510 · [email protected]
Related reactions
7 records
Compound notes
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