Basic information
- CAS
702-16-9- Standard SMILES
CCCCc1ccc(C)nc1- InChIKey
GSYSNSTWMPZEQK-UHFFFAOYSA-N- Molecular formula
- C10H15N
- Average molar mass
- 149.23 g/mol
- Monoisotopic mass
- 149.12044948
Names & identifiers
- Preferred name
- 5-Butyl-2-methylpyridine
- IUPAC
- 5-butyl-2-methylpyridine
- English name
- 5-Butyl-2-methyl-pyridine
- Molecular formula
- C10H15N
- Molecular weight
- 149.23
Names & synonyms
5-Butyl-2-methylpyridine2-Methyl-5-butylpyridinePyridine, 5-butyl-2-methyl-EINECS 211-865-0DTXSID0061030RefChem:102226DTXCID0046640211-865-0GSYSNSTWMPZEQK-UHFFFAOYSA-N702-16-95-Butyl-2-methyl-pyridine5-butyl-2-picoline
Show more names
5-Butyl-picoline2-Picoline, 5-butyl-2PZ7JBU6ZQ2-methyl-5-butyl pyridineSCHEMBL1971057SCHEMBL9661371AKOS006283290FB52373
Database identifiers
- CAS
702-16-9- PubChem CID
- 69704
- DTXSID
DTXSID0061030- UNII
- 2PZ7JBU6ZQ
- EC Number
- 211-865-0
- Nikkaji
- J28.098D
Properties
Computed structural properties
- XLogP
- 3.1
- Topological polar surface area
- 12.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 3
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 101
Physicochemical properties
- Boiling point
- 89 °C · 89 °C(Press: 12 Torr)
- Density
- 0.9018 g/cm3 · 0.9018 g/cm3(Temp: 21.8 °C)
- pka
- 6.28 · 6.28±0.10(Predicted)
- EPA Substance Registry System
- 5 · 5-Butyl-2-methylpyridine (702-16-9)
- TSCA
- TSCA listed
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- tsca
- TSCA listed
Chemistry & industry
Uses & manufacturing
General Manufacturing InformationPyridine, 5-butyl-2-methyl-: INACTIVE
Upstream & downstream products
Downstream products
Suppliers6 total
武汉凯威斯科技有限公司86-027-67849912 · [email protected]
武汉凯威斯科技有限公司027-67849912 · [email protected]
深圳聚合生化科技有限公司+86-400-002-6226 13028896684 · [email protected]
北京百灵威科技有限公司18210857532 18210857532 · [email protected]
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]
上海信旗医药科技有限公司+86-21-54098501 · [email protected]
Related reactions
1 records
Compound notes
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