68608-12-8
Dodecane-1-sulfonamide(Dodecane-1-sulfonamide)
CAS: 68608-12-8
化学式: C12H27NO2S
| 中文名 | Dodecane-1-sulfonamide |
| 英文名 | Dodecane-1-sulfonamide |
| 英文别名 | Sulfonamides, C9-12-alkane dodecanesulfonamide (C9-C12)Alkyl sulfamoyl |
| CAS | 68608-12-8 |
| EINECS | 614-654-5 |
| 化学式 | C12H27NO2S |
| 分子量 | 249.42 |
| InChI | 1S/C12H27NO2S/c1-2-3-4-5-6-7-8-9-10-11-12-16(13,14)15/h2-12H2,1H3,(H2,13,14,15) |
| InChIKey | COMFSPSZVXMTCM-UHFFFAOYSA-N |
| 密度 | 0.992g/cm3 |
| 沸点 | 364.6°C at 760 mmHg |
| 闪点 | 174.3°C |
| 蒸汽压 | 1.66E-05mmHg at 25°C |
| 折射率 | 1.469 |
68608-12-8 - Computed Properties
| Property Name | Property Value | Reference |
|---|---|---|
| Molecular Weight | 249.42 | Computed by PubChem 2.1 (PubChem release 2021.05.07) |
| XLogP3-AA | 4.5 | Computed by XLogP3 3.0 (PubChem release 2019.06.18) |
| Hydrogen Bond Donor Count | 1 | Computed by Cactvs 3.4.6.11 (PubChem release 2019.06.18) |
| Hydrogen Bond Acceptor Count | 3 | Computed by Cactvs 3.4.6.11 (PubChem release 2019.06.18) |
| Rotatable Bond Count | 11 | Computed by Cactvs 3.4.6.11 (PubChem release 2019.06.18) |
| Exact Mass | 249.17625028 | Computed by PubChem 2.1 (PubChem release 2021.05.07) |
| Monoisotopic Mass | 249.17625028 | Computed by PubChem 2.1 (PubChem release 2021.05.07) |
| Topological Polar Surface Area | 68.5 Ų | Computed by Cactvs 3.4.6.11 (PubChem release 2019.06.18) |
| Heavy Atom Count | 16 | Computed by PubChem |
| Formal Charge | 0 | Computed by PubChem |
| Complexity | 232 | Computed by Cactvs 3.4.6.11 (PubChem release 2019.06.18) |
| Isotope Atom Count | 0 | Computed by PubChem |
| Defined Atom Stereocenter Count | 0 | Computed by PubChem |
| Undefined Atom Stereocenter Count | 0 | Computed by PubChem |
| Defined Bond Stereocenter Count | 0 | Computed by PubChem |
| Undefined Bond Stereocenter Count | 0 | Computed by PubChem |
| Covalently-Bonded Unit Count | 1 | Computed by PubChem |
| Compound Is Canonicalized | Yes | Computed by PubChem (release 2011.04.04) |
最后更新：2023-08-16 23:22:23
