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Basic information
- CAS
693-55-0- Standard SMILES
CCOC(=O)CCCCCCCCC(=O)O- InChIKey
DLZCDMPHHUODDO-UHFFFAOYSA-N- Molecular formula
- C12H22O4
- Average molar mass
- 230.3 g/mol
- Monoisotopic mass
- 230.15180918
Names & identifiers
- Preferred name
- Decanedioic acid, 1-ethyl ester
- IUPAC
- 10-ethoxy-10-oxodecanoic acid
- English name
- Ethyl hydrogen sebacate
- Molecular formula
- C12H22O4
- Molecular weight
- 230.3
Names & synonyms
10-ethoxy-10-oxodecanoic acidEthyl hydrogen sebacateDecanedioic acid, 1-ethyl esterMonoethyl sebacateSebacic acid, monoethyl esterDecanedioic acid, monoethyl ester5QK6SW872QEINECS 211-753-1NSC 53961NSC-53961Sebacic acid, ethyl esterDTXSID80883479
Show more names
SebacicaciSebacicacidmonoethylester10-ethoxy-10-oxodecanoateSebacic acid 1-ethyl ester10-ethoxy-10-keto-capric acidDecanedioic acid 1-ethyl ester10-ethoxy-10-oxo-decanoic acid
RefChem:585387DTXCID501023008693-55-0Decanedioic acid monoethyl esterMFCD00014387Sebacinsaureathylester1-Ethyl decanedioateMONO-ETHYL SEBACATE
Database identifiers
- CAS
693-55-0- PubChem CID
- 69660
- DTXSID
DTXSID80883479- UNII
- 5QK6SW872Q
- EC Number
- 211-753-1
- Nikkaji
- J21.780H
Properties
Computed structural propertiesFilling in
- XLogP
- 2.8
- Topological polar surface area
- 63.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 11
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 201
Physicochemical properties
- Melting point
- 35 · 35-38°C
- Boiling point
- 336 ℃ · 336℃
- Density
- 1.024 · 1.024
- Flash point
- 119 ℃ · 119℃
- BRN
- 1782569 · 1782569
- FDA UNII
- 5 QK6SW872Q · 5QK6SW872Q
- EPA Substance Registry System
- Decanedioic acid, monoethyl ester (693-55-0)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 315 · H315-H319-H335
- Precautionary statements
- 261 · P261-P280a-P304+P340-P305+P351+P338-P405-P501a
- Risk Statements
- 36 · 36/37/38
- Safety Statements
- 26 · 26-36
- TSCA
- TSCA listed
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
- tsca
- TSCA listed
- risk_code
- 36/37/38
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- safety_code
- 26-36
- Hazard statements
- H315-H319-H335
- Precautionary statements
- P261-P280a-P304+P340-P305+P351+P338-P405-P501a
Chemistry & industry
Suppliers24 total
杭州摩库生物医药科技有限公司+86-057181025280; +8617767106207 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
上海迈瑞尔生化科技有限公司4006356688 18621169109 · [email protected]
阿法埃莎（中国）化学有限公司400-6106006 · [email protected]
安耐吉化学&3A（安徽泽升科技股份有限公司）400-0056266 · [email protected]
湖北兴琰新材料科技有限公司13129948835 · [email protected]
梯希爱（上海）化工贸易有限公司021-61109150 · [email protected]
武汉丰泰威远科技有限公司+86-27-8746-5837 +86-18627785180 · [email protected]
武汉丰泰威远科技有限公司027-87465837 19945049750 · [email protected]
上海马氏化学科技有限公司19916721580 · [email protected]
上海鑫凯化学科技有限公司021-58930698 15921516558 · [email protected]
Alfa Chemistry1-516-6625404 · [email protected]
湖北世腾化工科技有限公司19086915685 18971850150 · [email protected]
安徽宏瀚研新药业有限公司0551-62626652 19334025048 · [email protected]
Shaanxi Didu New Materials Co. Ltd+86-86-17392712779 +86-13289823923 · [email protected]
杭州洁汉化工有限公司+86-571-86217390; +8618058761490 · [email protected]
江苏艾康生物医药研发有限公司025-58859352 19370895928 · [email protected]
武汉福鑫化工有限公司027-59207852 13308628970 · [email protected]
XIAMEN AMITY INDUSTRY AND TRADE CO., LTD.+8618950047208 · [email protected]
SUZHOU SENFEIDA CHEMICAL CO.,LTD+86-0512-83500002 +86-15195660023 · [email protected]
陕西缔都医药有限责任公司81148925 17391631969 · [email protected]
上海陶术生物科技股份有限公司+1-781-999-5354 · [email protected]
武汉浩荣生物科技有限公司13217229939 · [email protected]
河南君悦健生物科技有限公司1555-0142250 18661514130 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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