Basic information
- CAS
41832-84-2- Standard SMILES
N#CCCNCCN1CCOCC1- InChIKey
ZNDCJNWMQMVSQG-UHFFFAOYSA-N- Molecular formula
- C9H17N3O
- Average molar mass
- 183.25 g/mol
- Monoisotopic mass
- 183.13716217
Names & identifiers
- Preferred name
- 3-((2-(Morpholin-4-yl)ethyl)amino)propanenitrile
- IUPAC
- 3-(2-morpholin-4-ylethylamino)propanenitrile
- English name
- 3-[(2-Morpholin-4-ylethyl)amino]propanenitrile
- Molecular formula
- C9H17N3O
- Molecular weight
- 0
Names & synonyms
3-{[2-(morpholin-4-yl)ethyl]amino}propanenitrile3-((2-(Morpholin-4-yl)ethyl)amino)propanenitrileRefChem:488220971-646-741832-84-23-[(2-morpholin-4-ylethyl)amino]propanenitrile3-((2-Morpholinoethyl)amino)propanenitrile3-(2-morpholin-4-ylethylamino)propanenitrileHMS1749C07SCHEMBL14007436DTXSID20368492RBA83284
Show more names
AKOS0051359243-(2-morpholinoethylamino)propanenitrileCS-0221245EN300-08689G34921Z53117635
Database identifiers
- CAS
41832-84-2- PubChem CID
- 2398095
- DTXSID
DTXSID20368492- EC Number
- 971-646-7
Properties
Computed structural properties
- XLogP
- -0.8
- Topological polar surface area
- 48.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 169
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
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)
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%)
Chemistry & industry
Suppliers5 total
Ryan Scientific, Inc.[email protected]
圣克鲁斯生物技术（上海）有限公司021-60936350 · [email protected]
爱必信（上海）生物科技有限公司021-38015121-8802 · [email protected]
ENAMINE-CHI[email protected]
宝欧信特生物科技（苏州）有限公司51288865780 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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