Basic information
- CAS
502639-08-9- Standard SMILES
COCCN1CCC(N)CC1- InChIKey
ILMDRDDKNWKCNX-UHFFFAOYSA-N- Molecular formula
- C8H18N2O
- Average molar mass
- 158.24 g/mol
- Monoisotopic mass
- 158.1419132
Names & identifiers
- Preferred name
- 1-(2-Methoxyethyl)piperidin-4-amine
- IUPAC
- 1-(2-methoxyethyl)piperidin-4-amine
- English name
- 4-Piperidinamine,1-(2-methoxyethyl)-(9CI)
- Molecular formula
- C8H18N2O
- Molecular weight
- 158.24
Names & synonyms
1-(2-methoxyethyl)piperidin-4-amine502639-08-9DTXSID90602719RefChem:223639DTXCID10553476817-803-41-(2-Methoxy-ethyl)-piperidin-4-ylamineMFCD097591824-Piperidinamine,1-(2-methoxyethyl)-(9CI)SCHEMBL1957601SCHEMBL2443347ILMDRDDKNWKCNX-UHFFFAOYSA-N
Show more names
1-(2-Methoxy-ethyl)-piperidin-4-yla1-(2-methoxyethyl)-4-piperidinamine1-(2-methoxyethyl) piperidine-4-amine4-PiperidinaMine, 1-(2-Methoxyethyl)-
CVA639084-amino N-(2-methoxyethyl)piperidine4-Amino-1-(2-methoxyethyl)piperidineAKOS000158833SB135861-(2-Methoxy-ethyl)-piperidin4-ylamineBS-13397DB-014518
Database identifiers
- CAS
502639-08-9- PubChem CID
- 20119121
- DTXSID
DTXSID90602719- EC Number
- 817-803-4
Properties
Computed structural properties
- XLogP
- -0.3
- Topological polar surface area
- 38.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 100
Physicochemical properties
- Boiling point
- 212.1 · 212.1±30.0 °C(Predicted)
- Density
- 0.955 · 0.955±0.06 g/cm3(Predicted)
- storage temp.
- 2 · 2-8°C
- pka
- 10.45 · 10.45±0.20(Predicted)
- Symbol(GHS)
- 5 · GHS05
- Signal word
- Danger
- Hazard statements
- 314 · H314
- Precautionary statements
- 260 · P260-P264-P280-P301+P330+P331-P303+P361+P353-P304+P340-P305+P351+P338-P310-P321-P363-P405-P501
Safety & regulation
GHS classification
GHS Classification
Danger
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P354+P338, P317, P319, P321, P330, P332+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 2 reports by companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Safety data
- Signal word
- Danger
- Symbol(GHS)
- GHS05
- Hazard statements
- H314
- Precautionary statements
- P260-P264-P280-P301+P330+P331-P303+P361+P353-P304+P340-P305+P351+P338-P310-P321-P363-P405-P501
Chemistry & industry
Suppliers14 total
宁波振岳医药科技有限公司19817745290 · [email protected]
河北贝克曼生物科技有限公司15961617865 15961617865 · [email protected]
南通菡芳生物科技有限公司[email protected] 18017580634 · [email protected]
Hangzhou Sage Chemical Co., Ltd.+86057186818502 13588463833 · [email protected]
江苏药恒医药科技有限公司13524761129 · [email protected]
上海恩诺生物科技有限公司+86 (21) 6435-5022
砌块化学科技（上海）有限公司021-20432219 13918097649 · [email protected]
江苏艾康生物医药研发有限公司025-66028182 17714375163 · [email protected]
济南明觉生物医药科技有限公司15628895690 · [email protected]
济宁一泽医药科技有限公司15192473210 · [email protected]
成都圣美凯生物科技有限公司028-85157043 15882256948 · [email protected]
宁波振岳医药科技有限公司0086-19817745290; 19817745290 · [email protected]
重庆卡兰医药有限公司[email protected]
北京新研汇医药研发有限公司13969155946 · [email protected]
Related reactions
23 records
Compound notes
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