Basic information
- CAS
50634-05-4- Standard SMILES
COC1CC(C=O)C(OC)O1- InChIKey
QMIGEDXMDGEZSR-UHFFFAOYSA-N- Molecular formula
- C7H12O4
- Average molar mass
- 160.17 g/mol
- Monoisotopic mass
- 160.07355886
Names & identifiers
- Preferred name
- Tetrahydro-2,5-dimethoxyfuran-3-carbaldehyde
- IUPAC
- 2,5-dimethoxyoxolane-3-carbaldehyde
- English name
- 2,5-Dimethoxy-3-tetrahydrofurancarboxaldehyde
- Molecular formula
- C7H12O4
- Molecular weight
- 160.17
Names & synonyms
EINECS 256-668-0Tetrahydro-2,5-dimethoxyfuran-3-carbaldehydeRefChem:897073256-668-050634-05-42,5-dimethoxyoxolane-3-carbaldehyde2,5-dimethoxytetrahydrofuran-3-carbaldehyde2,5-DIMETHOXY-3-TETRAHYDROFURANCARBOXALDEHYDEMFCD000102833-formyl-2,5-dimethoxytetrahydrofuran2,5-Dimethoxy-3-tetrahydrofurancarbaldehyde2,5-dimethoxytetrahydro-3-furancarboxaldehyde
Show more names
TIMTEC-BB SBB0039682,5-DiMe-3-4Hfurancarboxaldehyde2,5-dimethoxy-3-formyltetrahydrofuranTetrahydro-2,5-dimethoxy-3-furancarbaldehyde
tetrahydro-2,5-dimethoxy-3-furancarboxaldehyde2,5-Dimethoxy-3-tetrahydrofuran carboxaldehyde2,5-Dimethoxytetrahydro-3-furancarboxaldehyde, Technical Grade2,5-Dimethoxy-3-formyltetrahydrofuran; 2,5-Dimethoxy-tetrahydro-furan-4-carboxaldehyde; 3-Formyl-2,5-dimethoxytetrahydrofuran; Tetrahydro-2,5-dimethoxy-3-furancarboxaldehyde2,5-dimethoxy-tetrahydrofuran-3-carboxaldehydeSCHEMBL272746DTXSID20964872STR03845
Database identifiers
- CAS
50634-05-4
Properties
Computed structural properties
- XLogP
- -0.3
- Topological polar surface area
- 44.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 136
Physicochemical properties
- Boiling point
- 89 °C12 · 89 °C12 mm Hg(lit.)
- Density
- 1.129 g/mL · 1.129 g/mL at 25 °C(lit.)
- refractive index
- 20 · n20/D 1.4401(lit.)
- Flash point
- 178 °F · 178 °F
- storage temp.
- 2 · 2-8°C
- form
- Liquid
- Specific Gravity
- 1.129 · 1.129
- color
- Clear yellow to brown
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302+H312+H332-H315-H319-H335
- Precautionary statements
- 261 · P261-P280-P301+P312-P302+P352+P312-P304+P340+P312-P305+P351+P338
- Hazard Codes
- Xn
- Risk Statements
- 20 · 20/21/22-36/37/38
- Safety Statements
- 26 · 26-36/37/39
- WGK Germany
- 3 · 3
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
Warning
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+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 42 reports by companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Safety data
- wgk
- 3
- hs_code
- 29321900
- risk_code
- 20/21/22-36/37/38
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- Xn
- safety_code
- 26-36/37/39
- Hazard statements
- H302+H312+H332-H315-H319-H335
- Precautionary statements
- P261-P280-P301+P312-P302+P352+P312-P304+P340+P312-P305+P351+P338
Chemistry & industry
Applications
Uses2,5-Dimethoxy-3-tetrahydrofurancarboxaldehyde was used in the synthesis of 9-(3-formylpyrrol-1-yl) ester by reacting with ethyl 9-amino-4,5-dihydro-4-oxo-1,2,4- triazolo[1,5-a]quinoxaline-2-carboxylate.
Upstream & downstream products
Upstream raw materials
Suppliers22 total
江苏艾康生物医药研发有限公司025-025-66113011 15955137747 · [email protected]
Aladdin Scientific[email protected]
上海迈瑞尔生化科技有限公司4006356688 18621169109 · [email protected]
安耐吉化学&3A（安徽泽升科技股份有限公司）400-0056266 · [email protected]
上海瀚鸿科技股份有限公司021-54306202 13764082696 · [email protected]
玛雅试剂+86 (573) 82222445 (0)18006601000 452520369 · [email protected]
赛默飞世尔科技（中国）有限公司800-810-5118 · [email protected]
北京伊诺凯科技有限公司400-810-7969 010-59572699 · [email protected]
Sigma-Aldrich西格玛奥德里奇(上海)贸易有限公司021-61415566 800-8193336 · [email protected]
Related reactions
36 records
Compound notes
Loading…