Basic information
- CAS
51335-75-2- Standard SMILES
CCOC(=O)C1(C(=O)OCC)COC(C)(C)OC1- InChIKey
LRRLQBPVLCTGIE-UHFFFAOYSA-N- Molecular formula
- C12H20O6
- Average molar mass
- 260.28 g/mol
- Monoisotopic mass
- 260.12598836
Names & identifiers
- Preferred name
- Diethyl 2,2-dimethyl-1,3-dioxane-5,5-dicarboxylate
- IUPAC
- diethyl 2,2-dimethyl-1,3-dioxane-5,5-dicarboxylate
- English name
- NSC 693437
- Molecular formula
- C12H20O6
- Molecular weight
- 260.28
Names & synonyms
Diethyl 2,2-dimethyl-1,3-dioxane-5,5-dicarboxylate51335-75-2NSC 6934372,2-dimethyl-[1,3]dioxane-5,5-dicarboxylic acid diethyl esterMFCD176770752,2-Dimethyl-5,5-dicarbethoxy-1,3-dioxaneNSC693437NSC-1478061,3-Dioxane-5,5-dicarboxylic acid, 2,2-dimethyl-, 5,5-diethyl esterNSC147806722Y4ARB8XSCHEMBL1868349
Show more names
2,2-Dimethyl-[1,3]dioxane-5,5-dicarboxylic acid diethyl ester cz2, 2-DiMethyl-1,3-dioxacyclohexane-5,5-dicarboxylic acid, diethyl ester
DTXSID90301992LRRLQBPVLCTGIE-UHFFFAOYSA-N5,5-DIETHYL 2,2-DIMETHYL-1,3-DIOXANE-5,5-DICARBOXYLATEAKOS015917939NSC 147806NSC-693437AS-56249DA-34875
Database identifiers
- CAS
51335-75-2- PubChem CID
- 287722
- DTXSID
DTXSID90301992- UNII
- 722Y4ARB8X
Properties
Computed structural properties
- XLogP
- 0.9
- Topological polar surface area
- 71.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 6
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 293
Experimental & physicochemical properties
SpringerMaterials PropertiesChemical shift
Physicochemical properties
- Boiling point
- 276 ℃ · 276℃
- Density
- 1.114 · 1.114
- Flash point
- 113 ℃ · 113℃
- storage temp.
- 2 · 2-8°C
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302
- Precautionary statements
- 280 · P280-P305+P351+P338
Safety & regulation
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302
- Precautionary statements
- P280-P305+P351+P338
Chemistry & industry
Suppliers32 total
Career Henan Chemica Co+86-0371-86658258 +86-13203830695 · [email protected]
温州共赢化学有限公司+86-0086-577-64498589 +86-15355981851 · [email protected]
上海毕得医药科技股份有限公司400-1647117 13681763483 · [email protected]
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
北京华威锐科化工有限公司0757-86329057 18934348241 · [email protected]
上海辅欣医药科技有限公司+86-021-021-50872116 · [email protected]
上海安米克化学品有限公司微信 17321281695 18019252918 · [email protected]
Aceschem Inc.+1-817863-6948 +1-（817）863-6948 · [email protected]
上海珂华生物科技有限公司021-60455363 18019463053 · [email protected]
成都海品信医药科技有限公司85114309 18982182443 · [email protected]
HBCChem, Inc.+1-510-219-6317 · [email protected]
湖南华腾制药有限公司400-8592883 · [email protected]
广东翁江化学试剂有限公司0751-2886766 13927870850 · [email protected]
南京合巨药业有限公司25-57027686 17372956142 · [email protected]
南京普鑫医药科技有限公司17366295326 · [email protected]
上海平果医药科技有限公司021-20432229 · [email protected]
郑州汇聚化工有限公司0371-55900031 18137872243 · [email protected]
上海策嵘生物科技有限公司（定制合成实验室）13062833949 · [email protected]
上海康恩博医药科技有限公司400-1388-521 17510465506 · [email protected]
江苏艾康生物医药研发有限公司025-66113011 19370895928 · [email protected]
济南尚博医药股份有限公司0531-61320525 15866703830 · [email protected]
艾览（上海）化工科技有限公司400-668-9898 · [email protected]
上海晶石医药科技有限公司021-000000 · [email protected]
Nanjing Yushan Wanfang Biotechnology Co., Ltd.+86-025-84918180 +86-18014482516 · [email protected]
Aromsyn Co., Ltd.+86-0571-85585865 +86-13336024896 · [email protected]
爆牛贸易重庆有限公司+86-023-6139-8061 +86-86-13650506873 · [email protected]
武汉永利源医药科技有限公司15927337358 · [email protected]
上海凯为化学科技有限公司021-58461859 15821823057 · [email protected]
Alchem Pharmtech,Inc.8485655694 · [email protected]
河北药成医药科技有限责任公司19903117580 19903117510 · [email protected]
南京世洲生物科技有限公司025-85560043 13675144456 · [email protected]
Hefei TNJ Chemical Industry Co.,Ltd.+86-0551-65418671 +86-189 4982 3763 · [email protected]
Related reactions
11 records
Compound notes
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