2,3,4-Trimethylpyridine

HCID 16691
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Basic information

CAS
2233-29-6
Standard SMILES
Cc1ccnc(C)c1C
InChIKey
HOPRXXXSABQWAV-UHFFFAOYSA-N
Molecular formula
C8H11N
Average molar mass
121.18 g/mol
Monoisotopic mass
121.08914935

Names & identifiers

Preferred name
2,3,4-Trimethylpyridine
IUPAC
2,3,4-trimethylpyridine
English name
2,3,4-trimethylpyridine
Molecular formula
C8H11N
Molecular weight
121.17964

Names & synonyms

2,3,4-TRIMETHYLPYRIDINE2233-29-62,3,4-CollidinePyridine, 2,3,4-trimethyl-EINECS 218-775-0UNII-720P8M59GM720P8M59GMDTXSID90176869RefChem:81342DTXCID0099360218-775-0HOPRXXXSABQWAV-UHFFFAOYSA-N
Show more names
NISTC2233296
Pyridine, trimethyl-2,3,4-trimethyl-pyridineSCHEMBL7488SCHEMBL311881SCHEMBL3391797SCHEMBL5011776SCHEMBL18305013DB-191877

Database identifiers

CAS
2233-29-6
PubChem CID
16691
DTXSID
DTXSID90176869
UNII
720P8M59GM
EC Number
218-775-0
Nikkaji
J213.126I

Properties

Computed structural properties

XLogP
2
Topological polar surface area
12.9 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
1
Rotatable bonds
0
Heavy atoms
9

Experimental & physicochemical properties

SpringerMaterials PropertiesOptical coefficient

Physicochemical properties

Melting point
-56.98 °C · -56.98°C (estimate)
Boiling point
180.91 °C · 180.91°C (estimate)
Density
0.9127 · 0.9127
refractive index
1.515 · 1.5150
FDA UNII
720 P8M59GM · 720P8M59GM

Chemistry & industry

Applications

Uses2,3,4-Trimethylpyridine was used to establish consistent vibrational assignments for use in statistical-thermodynamic calculations.

Upstream & downstream products

Downstream products

Suppliers8 total

山东洛克化工有限公司17653113209 13065062079 · [email protected]
山东智尚新材料有限公司+8617653113209 · [email protected]
上海安米克化学品有限公司微信 17321281695 18019252918 · [email protected]
Shaanxi Dideu New Materials Co. Ltd18192503167 · [email protected]
SHANDONG ZHI SHANG CHEMICAL CO.LTD0531-68652808 18953170293 · [email protected]

Related reactions

18 records
New reaction record

Compound notes

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