Cas no 129244-98-0 (7-Methylsulfinylheptyl Isothiocyanate)
129244-98-0 structure
Product Name:7-Methylsulfinylheptyl Isothiocyanate
CAS No:129244-98-0
MF:C9H17NOS2
MW:219.367379903793
CID:1223871
PubChem ID:9837367
Update Time:2025-07-31
7-Methylsulfinylheptyl Isothiocyanate Chemical and Physical Properties
Names and Identifiers
-
- Heptane, 1-isothiocyanato-7-(methylsulfinyl)-
- 1-ISOTHIOCYANATO-7-(METHYLSULFINYL)-HEPTANE
- 1-isothiocyanato-7-methylsulfinylheptane
- 7-METHYLSULFINYLHEPTYL ISOTHIOCYANATE
- OGYHCBGORZWBPH-UHFFFAOYSA-N
- 1-Isothiocyanato-7-(methylsulfinyl)heptane
- DTXSID60431578
- 129244-98-0
- CHEBI:138800
- 7-methylsulphinylheptyl isothiocyanate
- 1-ISOTHIOCYANATO-7-METHANESULFINYLHEPTANE
- SCHEMBL1607124
- 7-Methylsulfinylheptyl Isothiocyanate
-
- Inchi： 1S/C9H17NOS2/c1-13(11)8-6-4-2-3-5-7-10-9-12/h2-8H2,1H3
- InChI Key： OGYHCBGORZWBPH-UHFFFAOYSA-N
- SMILES： S(C)(CCCCCCCN=C=S)=O
Computed Properties
- Exact Mass: 219.07531
- Monoisotopic Mass: 219.07515651g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 13
- Rotatable Bond Count: 8
- Complexity: 188
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 1
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 2.7
- Topological Polar Surface Area: 80.7?2
Experimental Properties
- PSA: 29.43
7-Methylsulfinylheptyl Isothiocyanate Pricemore >>
| Related Categories | No. | Product Name | Cas No. | Purity | Specification | Price | update time | Inquiry |
|---|---|---|---|---|---|---|---|---|
| TRC | M493170-10mg |
7-Methylsulfinylheptyl Isothiocyanate |
129244-98-0 | 10mg |
$201.00 | 2023-05-17 | ||
| TRC | M493170-50mg |
7-Methylsulfinylheptyl Isothiocyanate |
129244-98-0 | 50mg |
$913.00 | 2023-05-17 | ||
| TRC | M493170-100mg |
7-Methylsulfinylheptyl Isothiocyanate |
129244-98-0 | 100mg |
$ 1800.00 | 2023-09-06 | ||
| LKT Labs | I7456-10mg |
1-Isothiocyanato-7-(methylsulfinyl)-heptane |
129244-98-0 | ≥98% | 10mg |
$218.90 | 2024-05-21 | |
| LKT Labs | I7456-25mg |
1-Isothiocyanato-7-(methylsulfinyl)-heptane |
129244-98-0 | ≥98% | 25mg |
$515.90 | 2024-05-21 | |
| LKT Labs | I7456-50mg |
1-Isothiocyanato-7-(methylsulfinyl)-heptane |
129244-98-0 | ≥98% | 50mg |
$825.10 | 2024-05-21 | |
| LKT Labs | I7456-100mg |
1-Isothiocyanato-7-(methylsulfinyl)-heptane |
129244-98-0 | ≥98% | 100mg |
$1443.50 | 2024-05-21 | |
| LKT Labs | I7456-10 mg |
1-Isothiocyanato-7-(methylsulfinyl)-heptane |
129244-98-0 | ≥98% | 10mg |
$208.50 | 2023-07-11 | |
| LKT Labs | I7456-25 mg |
1-Isothiocyanato-7-(methylsulfinyl)-heptane |
129244-98-0 | ≥98% | 25mg |
$491.30 | 2023-07-11 | |
| LKT Labs | I7456-50 mg |
1-Isothiocyanato-7-(methylsulfinyl)-heptane |
129244-98-0 | ≥98% | 50mg |
$785.80 | 2023-07-11 |
7-Methylsulfinylheptyl Isothiocyanate Related Literature
-
Li-Hua Gan,Rui Wu,Jian-Lei Tian,Patrick W. Fowler Phys. Chem. Chem. Phys., 2017,19, 419-425
-
Mark D. Allendorf,Alauddin Ahmed,Tom Autrey,Jeffrey Camp,Eun Seon Cho,Maciej Haranczyk,Abhi Karkamkar,Di-Jia Liu,Katie R. Meihaus,Iffat H. Nayyar,Roman Nazarov,Donald J. Siegel,Vitalie Stavila,Jeffrey J. Urban,Srimukh Prasad Veccham,Brandon C. Wood Energy Environ. Sci., 2018,11, 2784-2812
-
Huifang Yang,Haoran Guo,Peidong Fan,Xinpan Li,Wenlu Ren,Rui Song Nanoscale, 2020,12, 7024-7034
-
Xin Fu,Qing-rong Liang,Rong-guang Luo,Yan-shu Li,Xiao-ping Xiao,Lu-lu Yu,Wen-zhe Shan,Guang-qin Fan J. Mater. Chem. B, 2019,7, 3088-3099
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