Basic information
- CAS
2607-03-6- Standard SMILES
COC(=O)C1CCC1C(=O)OC- InChIKey
WEPHXFVXUXMCLE-UHFFFAOYSA-N- Molecular formula
- C8H12O4
- Average molar mass
- 172.18 g/mol
- Monoisotopic mass
- 172.07355886
Names & identifiers
- Preferred name
- Dimethyl cyclobutane-1,2-dicarboxylate
- IUPAC
- dimethyl cyclobutane-1,2-dicarboxylate
- English name
- CIS-1,2-CYCLOBUTANEDICARBOXYLIC ACID DIMETHYL ESTER
- Molecular formula
- C8H12O4
- Molecular weight
- 172.18
Names & synonyms
Dimethyl cyclobutane-1,2-dicarboxylate3396-20-11,2-Cyclobutanedicarboxylic acid, dimethyl esterNS4GT4WQQ8NSC-527269DTXSID90948947RefChem:1083693DTXCID509694562607-03-61,2-dimethyl cyclobutane-1,2-dicarboxylateMFCD01734157METHYL CYCLOBUTANE-1,2-DICARBOXYLATE
Show more names
cyclobutane-1,2-dicarboxylic acid dimethyl esterCIS-DIMETHYL CYCLOBUTANE-1,2-DICARBOXYLATEdimethyl (1r,2s)-cyclobutane-1,2-dicarboxylate1β,2α-Cyclobutanedicarboxylic acid dimethyl ester1,2-dimethyl (1R,2S)-cyclobutane-1,2-dicarboxylateCis-diMethyl-1, 2-cyclobutane dicarboxylate (CBDE)(1β,2β)-1,2-Cyclobutanedicarboxylic acid dimethyl ester(1R)-Cyclobutane-1β,2β-dicarboxylic acid dimethyl ester1,2-dimethyl cis-cyclobutane-1,2-dicarboxylate - [D85989]
Cyclobutane-1,2-dicarboxylic acid, dimethyl esterSB22499AS-69928SY1263701,2-Cyclobutanedicarboxylic acid, dimethyl ester, cis-cis-1,2-Cyclobutanedicarboxylic acid dimethyl esterCAA60703UNII-NS4GT4WQQ8
Database identifiers
- CAS
2607-03-6、3396-20-1- PubChem CID
- 137657
- DTXSID
DTXSID90948947- UNII
- NS4GT4WQQ8
- Nikkaji
- J124.805G
Properties
Computed structural properties
- XLogP
- 0.4
- Topological polar surface area
- 52.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 177
Physicochemical properties
- Boiling point
- 225 ℃ · 225℃
- Density
- 1.177 · 1.177
- refractive index
- 1.4455 · 1.4455 (estimate)
- Flash point
- 106 ℃ · 106℃
- storage temp.
- 0 · Store at 0-8 °C
- Appearance
- light yellow liquid
- CAS DataBase Reference
- 2607 · 2607-03-6
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 261 · P261-P280-P301+P312-P302+P352-P305+P351+P338
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
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P261-P280-P301+P312-P302+P352-P305+P351+P338
Chemistry & industry
Suppliers28 total
宁波振岳医药科技有限公司19817745290 · [email protected]
Career Henan Chemica Co+86-0371-86658258 +86-13203830695 · [email protected]
江苏艾康生物医药研发有限公司025-66061636 19370895928 · [email protected]
Suzhou ARTK Medchem Co., Ltd.+86-18168183658 · [email protected]
Baoji Guokang Healthchem co.,ltd+8615604608665 15604608665 · [email protected]
Aladdin Scientific[email protected]
江苏南创化学与生命健康研究院有限公司15720605021 · [email protected]
上海迈瑞尔生化科技有限公司4006356688 18621169109 · [email protected]
梯希爱（上海）化工贸易有限公司021-61109150 · [email protected]
江苏律恒生物医药有限公司18936227980 · [email protected]
赛纳斯特化学（欢迎点击联系）021-60343070
Labnetwork lnc.+86-27-50766799 +86-18062016861 · [email protected]
陕西缔都医药化工有限公司+86-029-81138252 +86-173 9270 1263 · [email protected]
上海依赫生物科技有限公司021-68882955 17721395025 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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