4-Hexylresorcinol (CAS 136-77-6) — formula C12H18O2, molecular weight 194.13 g/mol; category food additives.
| CAS Number | 136-77-6 |
|---|---|
| Molecular Formula | C12H18O2 |
| Molecular Weight | 194.13 g/mol |
| Melting Point | 154 to 156 °F (NTP, 1992) |
| Boiling Point | 631 °F at 760 mmHg (NTP, 1992) |
| LogP | log Kow = 3.45 |
| Packaging | 25/50kg 编织袋、20/25/50kg 纸板桶、200kg 塑料桶、1000kg IBC（以订单确认为准） |
| Applications | 典型应用领域：食品配料, 日化原料, 精细化工。规格, 纯度：以批次 COA 为准。包装：25, 50kg 编织袋, 20, 25, 50kg 纸板桶, 200kg 塑料桶, 1000kg IBC（以订单确认为准）。储存：阴凉干燥, 避光, 密封保存, 开封后尽快使用。样品 10~100g 或 100~500g, 贸易条款 FOB, CIF, CFR, 每批随附 COA, MSDS, SDS 按需。 |
| Category | Antioxidants |
Documented applications: 典型应用领域：食品配料, 日化原料, 精细化工。规格, 纯度：以批次 COA 为准。包装：25, 50kg 编织袋, 20, 25, 50kg 纸板桶, 200kg 塑料桶, 1000kg IBC（以订单确认为准）。储存：阴凉干燥, 避光, 密封保存, 开封后尽快使用。样品 10~100g 或 100~500g, 贸易条款 FOB, CIF, CFR, 每批随附 COA, MSDS, SDS 按需。.
4-Hexylresorcinol is a food-grade compound with CAS registry number 136-77-6 and molecular formula C12H18O2 (molecular weight 194.13 g/mol), belonging to the food additives segment of chemical raw materials.
CAS number: 136-77-6
Its molecular formula C12H18O2 comprises 12 C, 18 H, 2 O atoms.
Also known as: 4-Hexylresorcinol · 4-正己基间苯二酚
Category: food additives
The CAS registry number of 4-Hexylresorcinol is 136-77-6.
Molecular formula C12H18O2, molecular weight 194.13 g/mol.
It is also registered under: 4-Hexylresorcinol, 4-正己基间苯二酚.
Recorded applications: 典型应用领域：食品配料, 日化原料, 精细化工。规格, 纯度：以批次 COA 为准。包装：25, 50kg 编织袋, 20, 25, 50kg 纸板桶, 200kg 塑料桶, 1000kg IBC（以订单确认为准）。储存：阴凉干燥, 避光, 密封保存, 开封后尽快使用。样品 10~100g 或 100~500g, 贸易条款 FOB, CIF, CFR, 每批随附 COA, MSDS, SDS 按需。.
Category: Antioxidants.
Independent reference data for 4-Hexylresorcinol (CAS 136-77-6), compiled from public chemistry databases.
| CAS 号 | 136-77-6 |
|---|---|
| PubChem CID | 3610 |
| 分子式 | C12H18O2 |
| 分子量 | 194.13 g/mol |
| IUPAC 名称 | 4-hexylbenzene-1,3-diol |
| InChIKey | WFJIVOKAWHGMBH-UHFFFAOYSA-N |
| UNII（FDA） | R9QTB5E82N |
| ChEBI 编号 | CHEBI:93749 |
| ATC 编码（WHO） | R02AA12 |
| Molecular Weight | 194.27 |
|---|---|
| XLogP3 | 3.5 |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 2 |
| Rotatable Bond Count | 5 |
| Exact Mass | 194.130679813 |
| Monoisotopic Mass | 194.130679813 |
| Topological Polar Surface Area | 40.5 |
| Heavy Atom Count | 14 |
| Boiling Point | 631 °F at 760 mmHg (NTP, 1992) |
|---|---|
| Boiling Point | 334.00 °C. @ 760.00 mm Hg |
| Melting Point | 154 to 156 °F (NTP, 1992) |
| Melting Point | 62 to 67 °C |
| Melting Point | 67.5-69 °C |
| Melting Point | 68 - 70 °C |
| Solubility | In water, 500 mg/L at 18 °C |
| Solubility | 0.5 mg/mL at 18 °C |
| Vapor Pressure | 0.00000845 [mmHg] |
| LogP | log Kow = 3.45 |
hexylresorcinol; 4-Hexylresorcinol; 136-77-6; 4-hexylbenzene-1,3-diol; 4-Hexyl-1,3-benzenediol; 4-n-Hexylresorcinol; p-Hexylresorcinol; Antascarin; Ascaricid; Ascarinol; Caprokol; Crystoids; Oxana; Adrover; Hidesol; 4-Hexylresorcine
| 法规与食品接触 | ANTIOXIDANT; COLOUR_RETENTION_AGENT: Food Additives JECFA 无法确定 ADI 数值，但得出的结论是，甲壳类动物的处理浓度 TRS 859-JECFA 44/10 FAS 35-JECFA 44/105 |
|---|---|
| GHS 通报统计 | 1.7% (1 / 60) |
| GHS 通报统计 | 1.7% (1 / 60) |
|---|---|
| 已通报的危害声明 | H302 (98.3%), H315 (91.7%), H319 (95%), H335 (88.3%) |
4-正己基间苯二酚 的 CAS 号为 136-77-6，分子式 C12H18O2，分子量 194.13 g/mol。 UNII R9QTB5E82N; ChEBI 93749; InChIKey WFJIVOKAWHGMBH-UHFFFAOYSA-N. Boiling Point: 631 °F at 760 mmHg (NTP, 1992); Boiling Point: 334.00 °C. @ 760.00 mm Hg; Melting Point: 154 to 156 °F (NTP, 1992).
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.
中文页面: 4-正己基间苯二酚