Pyridine, 4-[1-(2-buten-1-yl)-3-penten-1-yl]-
Basic information
- CAS
13573-44-9- Standard SMILES
C/C=C/CC(C/C=C/C)c1ccncc1- InChIKey
ABNCIWHCOXTEEZ-GGWOSOGESA-N- Molecular formula
- C14H19N
- Average molar mass
- 201.31 g/mol
- Monoisotopic mass
- 201.15174961
Names & identifiers
- Preferred name
- Pyridine, 4-[1-(2-buten-1-yl)-3-penten-1-yl]-
- IUPAC
- 4-[(2E,7E)-nona-2,7-dien-5-yl]pyridine
- English name
- 4-[(2E,7E)-nona-2,7-dien-5-yl]pyridine mixture of isomers
- Molecular formula
- C14H19N
- Molecular weight
- 201.31
Names & synonyms
EINECS 218-154-4Pyridine, 4-(1-(2-buten-1-yl)-3-penten-1-yl)-Pyridine, 4-[1-(2-buten-1-yl)-3-penten-1-yl]-RefChem:8706634-(nona-2,7-dien-5-yl)pyridine13573-44-94-((2E,7E)-nona-2,7-dien-5-yl)pyridineT3FX2Y2Z7G2057-34-34-[(2E,7E)-nona-2,7-dien-5-yl]pyridine4-((3E)-1-((2E)-2-Butenyl)-3-pentenyl)pyridinePyridine, 4-(1-(2-butenyl)-3-pentenyl)-, (E,E)-
Show more names
5-(4-PYRIDYL)-2,7-NONADIENE, MIXTURE OF ISOMERSPyridine, 4-[1-(2-butenyl)-3-pentenyl]-, (E,E)- (8CI,9CI)4-[(2E,7E)-nona-2,7-dien-5-yl]pyridine mixture of isomers
4-{(3E)-1-[(2E)-2-butenyl]-3-pentenyl}pyridine4-[1-(2-butenyl)-3-pentenyl]pyridineUNII-T3FX2Y2Z7GSCHEMBL5145632ABNCIWHCOXTEEZ-GGWOSOGESA-NAKOS0243259034-(1-(But-2-enyl)pent-3-enyl)pyridine
Database identifiers
- CAS
13573-44-9、2057-34-3- PubChem CID
- 6147490
- UNII
- T3FX2Y2Z7G
- EC Number
- 218-154-4
- Nikkaji
- J298.673F
Properties
Computed structural properties
- XLogP
- 3.6
- Topological polar surface area
- 12.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 5
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 185
Physicochemical properties
- Boiling point
- 297.5 · 297.5±9.0 °C(Predicted)
- Density
- 0.919 · 0.919±0.06 g/cm3(Predicted)
- pka
- 5.89 · 5.89±0.26(Predicted)
- FDA UNII
- 3 FX2Y2Z7G · T3FX2Y2Z7G
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 261 · P261-P301+P312-P302+P352-P304+P340-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
H301 (100%): Toxic if swallowed [Danger Acute toxicity, oral]
P261, P264, P264+P265, P270, P271, P273, P280, P301+P316, 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. 3 (100%)
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P261-P301+P312-P302+P352-P304+P340-P305+P351+P338
Chemistry & industry
Uses & manufacturing
General Manufacturing InformationPyridine, 4-[1-(2-buten-1-yl)-3-penten-1-yl]-: INACTIVE
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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