(3-Ethylpyridin-4-yl)methanamine
Basic information
- CAS
1443980-94-6- Standard SMILES
CCc1cnccc1CN- InChIKey
OPQXIXQHINAEIN-UHFFFAOYSA-N- Molecular formula
- C8H12N2
- Average molar mass
- 136.19 g/mol
- Monoisotopic mass
- 136.10004839
Names & identifiers
- Preferred name
- (3-Ethylpyridin-4-yl)methanamine
- IUPAC
- (3-ethyl-4-pyridinyl)methanamine
- English name
- (3-ethylpyridin-4-yl)methanamine
- Molecular formula
- C8H12N2
- Molecular weight
- 136.19
Names & synonyms
(3-ethylpyridin-4-yl)methanamine1443980-94-6RefChem:400191986-403-03-Ethyl-4-pyridinemethanamineSCHEMBL21919812THC98094AKOS023832207DB-424922EN300-1150624-Pyridinemethanamine, 3-ethyl-
Database identifiers
- CAS
1443980-94-6- PubChem CID
- 71756908
- EC Number
- 986-403-0
Properties
Computed structural properties
- XLogP
- 0.5
- Topological polar surface area
- 38.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 93.3
Physicochemical properties
- Boiling point
- 246.5 · 246.5±25.0 °C(Predicted)
- Density
- 1.005 · 1.005±0.06 g/cm3(Predicted)
- pka
- 7.89 · 7.89±0.29(Predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 280 · P280-P305+P351+P338
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%)
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P280-P305+P351+P338
Suppliers
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Related reactions
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Compound notes
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