Basic information
- CAS
105-80-6- Standard SMILES
CC(C)COC(=O)CCCCCCCC(=O)OCC(C)C- InChIKey
KEVDDQOYWPSMFD-UHFFFAOYSA-N- Molecular formula
- C17H32O4
- Average molar mass
- 300.4 g/mol
- Monoisotopic mass
- 300.2300595
Names & identifiers
- Preferred name
- Nonanedioic acid, 1,9-bis(2-methylpropyl) ester
- IUPAC
- bis(2-methylpropyl) nonanedioate
- English name
- diisobutyl azelate
- Molecular formula
- C17H32O4
- Molecular weight
- 300.43
Names & synonyms
Nonanedioic acid, 1,9-bis(2-methylpropyl) esterRefChem:854493Diisobutyl nonanedioate105-80-6DIISOBUTYL AZELATENonanedioic acid, bis(2-methylpropyl) esterbis(2-methylpropyl) nonanedioateMFCD00048345Hallco 3880Azelaic acid, diisobutyl esterEINECS 203-333-1Diisobutylnonanedioate
Show more names
Hallco-3880DiisobutylazelaateNonanedioic acid bis(2-methylpropyl) esterNonanedioic acid,1,9-bis(2-methylpropyl) ester
Diisobutyl azelaate #di-(isobutyl)-azelateAI3-07964M9YL2HB9VC1,9-BIS(2-METHYLPROPYL) NONANEDIOATESCHEMBL1977708DTXSID5059323AKOS024258487
Database identifiers
- CAS
105-80-6- PubChem CID
- 7776
- DTXSID
DTXSID5059323- UNII
- M9YL2HB9VC
- EC Number
- 203-333-1
- Nikkaji
- J102.006D
Properties
Computed structural properties
- XLogP
- 4.9
- Topological polar surface area
- 52.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 14
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 257
Physicochemical properties
- storage temp.
- 2 · 2-8°C
- EPA Substance Registry System
- Nonanedioic acid, bis(2-methylpropyl) ester (105-80-6)
- 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
Chemistry & industry
Uses & manufacturing
General Manufacturing InformationNonanedioic acid, 1,9-bis(2-methylpropyl) ester: ACTIVE
Suppliers29 total
上海凌富药物研究有限公司+86(21)5895 0110 19945755304 · [email protected]
Career Henan Chemica Co+86-0371-86658258 +86-13203830695 · [email protected]
Sichuan Biosynce Pharmatech Co., Ltd.[email protected]
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
北京索莱宝科技有限公司010-50973130 17801761073 · [email protected]
上海辅欣医药科技有限公司+86-021-021-50872116 · [email protected]
Hangzhou Sage Chemical Co., Ltd.+86057186818502 13588463833 · [email protected]
梯希爱（上海）化工贸易有限公司021-61109150 · [email protected]
山东李比希生物医药科技有限公司17866677155 · [email protected]
吉林中科研伸科技有限公司18143011203 · [email protected]
菏泽博纳医药科技有限公司15865805009 · [email protected]
山东李比希生物医药科技有限公司15318973357; 15318973357 · [email protected]
ChemeGen 中国18818260767 · [email protected]
成都海品信医药科技有限公司85114309 18982182443 · [email protected]
越林试剂021-62960152 · [email protected]
陕西麟邦实业有限公司17709134430 · [email protected]
江苏艾康生物医药研发有限公司025-66028182 17714375163 · [email protected]
陕西缔都医药化工有限公司029-81024372 17792795018 · [email protected]
安耐吉化学&3A（安徽泽升科技股份有限公司）400-0056266 · [email protected]
上海瀚思化工有限公司18916268197 · [email protected]
上海书亚医药科技有限公司400-685-9117 · [email protected]
天津希恩思生化科技有限公司400-6387771-6039 18920764717 · [email protected]
ATK CHEMICAL COMPANY LIMITED+undefined-21-51877795 · [email protected]
爱诗伦生物科技（上海）有限公司021-50676523 18019098996 · [email protected]
郑州汇聚化工有限公司037155153829 18003835034 · [email protected]
上海相辉医药科技有限公司13611835272 13611835272 · [email protected]
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]
Honest Joy Holdings Limited755-36694831 +8613798234863 · [email protected]
Shaanxi Dideu Medichem Co. Ltd+86-17392712779 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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