benzyl methyl disulphide (CAS 699-10-5) — formula C8H10S2, molecular weight 170.3; category organic chemicals.
| CAS Number | 699-10-5 |
|---|---|
| Molecular Formula | C8H10S2 |
| Molecular Weight | 170.3 |
| Melting Point | 61.00 to 62.00 °C. @ 760.00 mm Hg |
| Boiling Point | 195.00 to 197.00 °C. @ 760.00 mm Hg |
| LogP | 2.4 |
| Category | Organic Chemicals |
benzyl methyl disulphide is a carbon-based organic compound with CAS registry number 699-10-5 and molecular formula C8H10S2 (molecular weight 170.3), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 699-10-5
Its molecular formula C8H10S2 comprises 8 C, 10 H, 2 S atoms.
Also known as: benzyl methyl disulphide · 甲基苄基二硫醚 · Benzyl Methyl Disulfide · Methyl benzyl disulfide
Category: organic chemicals
The CAS registry number of benzyl methyl disulphide is 699-10-5.
Molecular formula C8H10S2, molecular weight 170.3.
It is also registered under: benzyl methyl disulphide, 甲基苄基二硫醚, Benzyl Methyl Disulfide, Methyl benzyl disulfide.
Category: Organic Chemicals.
Independent reference data for benzyl methyl disulphide (CAS 699-10-5), compiled from public chemistry databases.
| CAS Registry Number | 699-10-5 |
|---|---|
| PubChem CID | 12779 |
| Molecular formula | C8H10S2 |
| Molecular weight | 170.02 g/mol |
| IUPAC name | (methyldisulfanyl)methylbenzene |
| InChIKey | NWYGPVZOBBHKLI-UHFFFAOYSA-N |
| UNII (FDA) | Q451CNJ59W |
| ChEBI ID | CHEBI:173775 |
| FEMA number | 3504 |
| JECFA number | 577 |
| Molecular Weight | 170.3 |
|---|---|
| XLogP3 | 2.4 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 2 |
| Rotatable Bond Count | 3 |
| Exact Mass | 170.02239267 |
| Monoisotopic Mass | 170.02239267 |
| Topological Polar Surface Area | 50.6 |
| Heavy Atom Count | 10 |
| Boiling Point | 195.00 to 197.00 °C. @ 760.00 mm Hg |
|---|---|
| Boiling Point | 82-86 °C (0.8 mm Hg) |
| Melting Point | 61.00 to 62.00 °C. @ 760.00 mm Hg |
| Density | 0.840 (d20/4) |
Benzyl methyl disulfide; Methyl benzyl disulfide; Disulfide, methyl phenylmethyl; Benzyldithiomethane; [(Methyldisulfanyl)methyl]benzene; Benzyl methyl disulphide; DISULFIDE, BENZYL METHYL; Methyl phenylmethyl disulfide; FEMA No. 3504; EINECS 211-826-8; UNII-Q451CNJ59W; NSC 677547; BRN 2079563; Q451CNJ59W; NSC-677547; METHYL BENZYL DISULPHIDE
| Regulatory & Food Contact | EU Flavoring substances FDA Substance added to food: FLAVORING AGENT OR ADJUVANT Flavoring Agents FLAVOURING_AGENT: Flavouring Agent Savory No safety concern at current levels of intake when used as a flavouring agent |
|---|
| Reported hazard statements | H302 (100%), H315 (72.8%), H319 (72.8%), H335 (72.8%) |
|---|
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
H315 (72.8%): Causes skin irritation [Warning Skin corrosion/irritation]
Methyl benzyl disulfide is identified by CAS 699-10-5, molecular formula C8H10S2 and molecular weight 170.02 g/mol. UNII Q451CNJ59W; ChEBI 173775; InChIKey NWYGPVZOBBHKLI-UHFFFAOYSA-N. Boiling Point: 195.00 to 197.00 °C. @ 760.00 mm Hg; Boiling Point: 82-86 °C (0.8 mm Hg); Melting Point: 61.00 to 62.00 °C. @ 760.00 mm Hg.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.
中文页面: 甲基苄基二硫醚