1-(methoxymethyl)propyl isothiocyanate (CAS 85099-02-1) — formula C6H11NOS, molecular weight 145.23; category organic chemicals.
| CAS Number | 85099-02-1 |
|---|---|
| Molecular Formula | C6H11NOS |
| Molecular Weight | 145.23 |
| LogP | 2.4 |
| Category | Organic Chemicals |
1-(methoxymethyl)propyl isothiocyanate is a carbon-based organic compound with CAS registry number 85099-02-1 and molecular formula C6H11NOS (molecular weight 145.23), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 85099-02-1
Its molecular formula C6H11NOS comprises 6 C, 11 H, 1 N, 1 O, 1 S atoms.
Also known as: 1-(methoxymethyl)propyl isothiocyanate · 1-(甲氧基甲基)丙基异硫氰酸酯
Category: organic chemicals
The CAS registry number of 1-(methoxymethyl)propyl isothiocyanate is 85099-02-1.
Molecular formula C6H11NOS, molecular weight 145.23.
It is also registered under: 1-(methoxymethyl)propyl isothiocyanate, 1-(甲氧基甲基)丙基异硫氰酸酯.
Category: Organic Chemicals.
Independent reference data for 1-(methoxymethyl)propyl isothiocyanate (CAS 85099-02-1), compiled from public chemistry databases.
| CAS 号 | 85099-02-1 |
|---|---|
| PubChem CID | 3020343 |
| 分子式 | C6H11NOS |
| IUPAC 名称 | 2-isothiocyanato-1-methoxybutane |
| UNII（FDA） | NS00058953 |
| Molecular Weight | 145.23 |
|---|---|
| XLogP3 | 2.4 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 3 |
| Rotatable Bond Count | 4 |
| Exact Mass | 145.05613515 |
| Monoisotopic Mass | 145.05613515 |
| Topological Polar Surface Area | 53.7 |
| Heavy Atom Count | 9 |
2-isothiocyanato-1-methoxybutane; 1-(Methoxymethyl)propyl isothiocyanate; EINECS 285-455-5; DTXSID101005474; RefChem:427976; DTXCID301432356; 285-455-5; 85099-02-1; Butane,2-isothiocyanato-1-methoxy-; IVNMWEWWGCVXEY-UHFFFAOYSA-N; AKOS013732368; NS00058953; G30636; EN300-7189614
| 已通报的危害声明 | H227 (100%), H302 (100%), H312 (100%), H315 (100%), H317 (100%), H318 (100%), H332 (100%), H334 (100%) |
|---|
1-(甲氧基甲基)丙基异硫氰酸酯 · CAS 85099-02-1 · C6H11NOS. UNII NS00058953.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.
中文页面: 1-(甲氧基甲基)丙基异硫氰酸酯