Basic information
- CAS
1020931-60-5- Standard SMILES
C#CCNCCOC- InChIKey
MFMIMCSNIHXRPA-UHFFFAOYSA-N- Molecular formula
- C6H11NO
- Average molar mass
- 113.16 g/mol
- Monoisotopic mass
- 113.08406397
Names & identifiers
- Preferred name
- (2-Methoxyethyl)(prop-2-yn-1-yl)amine
- IUPAC
- N-(2-methoxyethyl)prop-2-yn-1-amine
Names & synonyms
(2-methoxyethyl)(prop-2-yn-1-yl)amine1020931-60-5RefChem:396005962-877-4N-(2-methoxyethyl)prop-2-yn-1-amineSCHEMBL4459636AKOS000247391AT20722N-(2-Methoxyethyl)-2-propyn-1-amineEN300-1600612
Database identifiers
- CAS
1020931-60-5- PubChem CID
- 21843630
- EC Number
- 962-877-4
Properties
Computed structural properties
- XLogP
- -0.2
- Topological polar surface area
- 21.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 4
- Heavy atoms
- 8
- Formal charge
- 0
- Complexity
- 81.8
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
H226 (100%): Flammable liquid and vapor [Warning Flammable liquids]
P210, P233, P240, P241, P242, P243, P260, P261, P264, P270, P271, P280, P301+P317, P301+P330+P331, P302+P361+P354, P303+P361+P353, P304+P340, P305+P354+P338, P316, P319, P321, P330, P363, P370+P378, P403+P233, P403+P235, 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 CategoriesFlam. Liq. 3 (100%)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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