Pyridine, 2-methyl-4-(1-methylethyl)
Basic information
- CAS
13854-03-0- Standard SMILES
Cc1cc(C(C)C)ccn1- InChIKey
YWVVIBOXHWIQMY-UHFFFAOYSA-N- Molecular formula
- C9H13N
- Average molar mass
- 135.21 g/mol
- Monoisotopic mass
- 135.10479942
Overview
Pyridine, 2-methyl-4-(1-methylethyl) has been reported in Mentha arvensis with data available.
Names & identifiers
- Preferred name
- Pyridine, 2-methyl-4-(1-methylethyl)
- IUPAC
- 2-methyl-4-propan-2-ylpyridine
- English name
- 2-methyl-4-(propan-2-yl)pyridine
- Molecular formula
- C9H13N
- Molecular weight
- 135.21
Names & synonyms
13854-03-0Pyridine, 2-methyl-4-(1-methylethyl)DTXSID203361512-methyl-4-propan-2-ylpyridineRefChem:177582DTXCID70287240YWVVIBOXHWIQMY-UHFFFAOYSA-N2-methyl-4-(propan-2-yl)pyridine4-Isopropyl-2-methylpyridineSCHEMBL84469SCHEMBL4652466SCHEMBL4878671
Show more names
4-iso-propyl-2-methylpyridinePyridine, 2-methyl-4-(1-methylethyl)-
SCHEMBL5619501SCHEMBL30490644EN300-25386864
Database identifiers
- CAS
13854-03-0- PubChem CID
- 529348
- DTXSID
DTXSID20336151- EC Number
- 872-932-3
Properties
Computed structural properties
- XLogP
- 2.4
- Topological polar surface area
- 12.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 1
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 98.9
Physicochemical properties
- Boiling point
- 98 · 98-99 °C(Press: 40 Torr)
- Density
- 0.907 · 0.907±0.06 g/cm3(Predicted)
- pka
- 6.66 · 6.66±0.10(Predicted)
- Symbol(GHS)
- 7 · GHS07,GHS05
- Signal word
- Danger
- Hazard statements
- 315 · H315-H227-H335-H318
- Precautionary statements
- 264 · P264-P280-P302+P352-P321-P332+P313-P362-P210-P280-P370+P378-P403+P235-P501-P280-P305+P351+P338-P310
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
H227 (100%): Combustible liquid [Warning Flammable liquids]
P210, P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P354+P338, P317, P319, P321, P332+P317, P362+P364, P370+P378, P403, 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 CategoriesFlam. Liq. 4 (100%)
Safety data
- Signal word
- Danger
- Symbol(GHS)
- GHS07,GHS05
- Hazard statements
- H315-H227-H335-H318
- Precautionary statements
- P264-P280-P302+P352-P321-P332+P313-P362-P210-P280-P370+P378-P403+P235-P501-P280-P305+P351+P338-P310
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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