Basic information
- CAS
6231-18-1- Standard SMILES
COc1cccc(OC)n1- InChIKey
IBTGEEMBZJBBSH-UHFFFAOYSA-N- Molecular formula
- C7H9NO2
- Average molar mass
- 139.15 g/mol
- Monoisotopic mass
- 139.06332853
Names & identifiers
- Preferred name
- 2,6-Dimethoxypyridine
- IUPAC
- 2,6-dimethoxypyridine
- English name
- 2,6-Dimethoxypyridine
- Molecular formula
- C7H9NO2
- Molecular weight
- 139.15
Names & synonyms
2,6-Dimethoxypyridine6231-18-1Pyridine, 2,6-dimethoxy-EINECS 228-334-4DTXSID00871156RefChem:83272DTXCID40818828228-334-4IBTGEEMBZJBBSH-UHFFFAOYSA-NInChI=1/C7H9NO2/c1-9-6-4-3-5-7(8-6)10-2/h3-5H,1-2H2,6-Dimethoxy pyridineMFCD00006266
Show more names
2,6- twoMethoxypyridine2,6-Dimethoxypyridine>Pyridine, 2,6-dimethoxy-2,6-Dimethoxypyridine 98%2,6-Dimethoxypyridine,99%2,6-Dimethoxypyridine, 98+%2,6-DIMETHOXY PYRIDINE (TAX INVOICE NO:22,6-Dimethoxypyridine ISO 9001：2015 REACH
2,6-Dimethoxy-pyridineSCHEMBL1606022,6-Dimethoxypyridine, 98%DS-13432F11261F1905-7031Z1255423468122797-02-8
Database identifiers
- CAS
6231-18-1- PubChem CID
- 80378
- DTXSID
DTXSID00871156- EC Number
- 228-334-4
- Nikkaji
- J110.505A
Properties
Computed structural properties
- XLogP
- 2.3
- Topological polar surface area
- 31.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 87.6
Experimental & physicochemical properties
SpringerMaterials Properties15N nuclear magnetic resonance spectrum
LogP2.3
Ionization Efficiency
Positive
1.12
2.7
Agilent XCT
Electrospray ionization
formic acid (5.3nM)
Physicochemical properties
- Boiling point
- 178 · 178-180 °C (lit.)
- Density
- 1.053 g/mL · 1.053 g/mL at 25 °C (lit.)
- refractive index
- 20 · n20/D 1.503(lit.)
- Flash point
- 143 °F · 143 °F
- storage temp.
- Sealed in dry,Room Temperature
- form
- clear liquid
- pka
- 1.57 · 1.57±0.10(Predicted)
- Specific Gravity
- 1.053 · 1.053
- color
- Colorless to Almost colorless
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 (89.4%): Harmful if swallowed [Warning Acute toxicity, oral]
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P305+P354+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 47 reports by companies from 7 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (89.4%)
Safety data
- PPE
- Eyeshields, Faceshields, Gloves, type ABEK (EN14387) respirator filter
- wgk
- 3
- ridadr
- 1993
- hs_code
- 29333990
- risk_code
- 22-37/38-41-36/37/38-20/21/22
- Signal word
- Danger
- Symbol(GHS)
- GHS05,GHS07
- hazard_code
- Xn,Xi
- safety_code
- 26-39-36/37/39-36
- hazard_class
- 3.2
- Storage Class
- 10 - Combustible liquids
- packing_group
- III
- Hazard statements
- H302-H315-H318-H335
- Hazard Classifications
- Acute Tox. 4 OralEye Dam. 1Skin Irrit. 2STOT SE 3
Chemistry & industry
Applications
Uses2,6-Dimethoxypyridine is widely used in drug molecules, such as enzyme inhibitors/agonists, anti-HIV drugs, antibacterial drugs, and anesthetics.
Upstream & downstream products
Upstream raw materials
Suppliers100 total
国药集团化学试剂有限公司86-21-63210123 · [email protected]
梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
合肥翰刚医药科技有限公司+8618062405514 · [email protected]
INTATRADE GmbH+49 3493/605464 · [email protected]
泰州维生生物科技有限公司18351140886; 18351140886 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
Hebei Yanxi Chemical Co., Ltd.+86-17531190177 · [email protected]
上海将来实业股份有限公司400-0066400 13621662912 · [email protected]
Syntechem Co.,Ltd
Related reactions
11 records
Compound notes
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