Cas no 89136-90-3 (Propanoic acid,3-mercapto-, 6-methylheptyl ester)
89136-90-3 structure
Product Name:Propanoic acid,3-mercapto-, 6-methylheptyl ester
CAS No:89136-90-3
MF:C11H22O2S
MW:218.356182575226
CID:725532
PubChem ID:104386
Update Time:2025-04-19
Propanoic acid,3-mercapto-, 6-methylheptyl ester Chemical and Physical Properties
Names and Identifiers
-
- Propanoic acid,3-mercapto-, 6-methylheptyl ester
- 6-methylheptyl 3-mercaptopropionate
- 6-Methylheptyl 3-mercaptopropanoate
- C11H22O2S
- CS-W014784
- isooctyl-3-mercaptopropionate
- NS00007168
- 89136-90-3
- Isooctyl 3-mercaptopropionate, >=99%
- CAS-30374-01-7
- GQ2YYL7PUF
- E75854
- 3-mercaptopropionic acid isooctyl ester
- EC 250-157-6
- DSSTox_RID_80580
- A876210
- SCHEMBL56270
- ISOOCTYL3-MERCAPTOPROPIONATE
- DSSTox_CID_24911
- CHEMBL3184500
- MFCD00046846
- AKOS015916555
- Propanoic acid, 3-mercapto-, 6-methylheptyl ester
- EINECS 250-157-6
- 6-Methylheptyl 3-sulfanylpropanoate #
- Propanoic acid, 3-mercapto-, isooctyl ester
- DSSTox_GSID_44911
- DTXSID70274150
- FT-0755138
- LS-14026
- Propionic acid, 3-mercapto-, 6-methylheptyl ester
- Isooctyl 3-mercaptopropionate
- isooctyl mercaptopropionate
- NCGC00256140-01
- Tox21_301276
- EINECS 289-472-9
- 30374-01-7
- 6-Methylheptyl 3-sulfanylpropanoate
-
- MDL： MFCD00046846
- Inchi： 1S/C11H22O2S/c1-10(2)6-4-3-5-8-13-11(12)7-9-14/h10,14H,3-9H2,1-2H3
- InChI Key： ZHUWXKIPGGZNJW-UHFFFAOYSA-N
- SMILES： SCCC(=O)OCCCCCC(C)C
Computed Properties
- Exact Mass: 218.13405111g/mol
- Monoisotopic Mass: 218.13405111g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 14
- Rotatable Bond Count: 9
- Complexity: 146
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Surface Charge: 0
- Tautomer Count: nothing
- XLogP3: 3.5
- Topological Polar Surface Area: 27.3?2
Propanoic acid,3-mercapto-, 6-methylheptyl ester Related Literature
-
Thi Thu Tram Nguyen,Thanh Binh Nguyen Org. Biomol. Chem., 2021,19, 6015-6020
-
Max Attwood,Hiroki Akutsu,Lee Martin,Toby J. Blundell,Pierre Le Maguere,Scott S. Turner Dalton Trans., 2021,50, 11843-11851
-
Joseph W. Bennett,Diamond T. Jones,Blake G. Hudson,Joshua Melendez-Rivera,Robert J. Hamers,Sara E. Mason Environ. Sci.: Nano, 2020,7, 1642-1651
-
Sowmyalakshmi Venkataraman RSC Adv., 2015,5, 73807-73813
-
Tengfei Yu,Yuehan Wu,Wei Li,Bin Li RSC Adv., 2014,4, 34134-34143
89136-90-3 (Propanoic acid,3-mercapto-, 6-methylheptyl ester) Related Products
- 16215-21-7(Butyl- 3-mercaptopropionate)
- 50448-95-8(2-Ethylhexyl 3-Mercaptopropionate)
- 6380-71-8(Propanoic acid,3-mercapto-, dodecyl ester)
- 30374-01-7(Isooctyl 3-mercaptopropionate)
- 31778-15-1(Octadecyl 3-Mercaptopropionate (contains ca. 12% Hexadecyl 3-Mercaptopropionate))
- 71849-93-9(Propanoic acid,3-mercapto-, octyl ester)
- 50727-77-0(Propanoic acid,3-mercapto-, tridecyl ester)
- 2098070-20-1(2-(3-(Pyridin-3-yl)-1H-pyrazol-1-yl)acetimidamide)
- 2680771-01-9(4-cyclopentyl-3-{(prop-2-en-1-yloxy)carbonylamino}butanoic acid)
- 1444113-98-7(N-(3-cyanothiolan-3-yl)-2-[(2,2,2-trifluoroethyl)sulfanyl]pyridine-4-carboxamide)
Recommended suppliers
Shanghai Jinhuan Chemical CO., LTD.
Gold Member
Audited Supplier
CN Supplier
Bulk
Jinta Yudi Pharmaceutical Technology Co., Ltd.
Gold Member
Audited Supplier
CN Supplier
Bulk
Jiangsu Kolod Food Ingredients Co.,ltd
Gold Member
Audited Supplier
CN Supplier
Bulk
Jinan Hanyu Chemical Co.,Ltd.
Gold Member
Audited Supplier
CN Supplier
Bulk
Shaanxi pure crystal photoelectric technology co. LTD
Gold Member
Audited Supplier
CN Supplier
Reagent
