ヒメコウジ葉油

加水分解ヒメコウジ油 · ヒメコウジ葉エキス · ヒメコウジ葉油 · ウィンターグリーン油、冬緑油 · ヒメコウジ花／葉／茎油 · Gaultheria procumbens, ext. · Gaultheria procumbens extract · Gaultheria procumbens, Extrakt

https://huagongshe.com/ja/chemical/4133

識別子と物理属性

CAS No.	119-36-8
分子式	C8H8O3
平均分子量	152.15 g/mol
単同位体質量	152.04734412 g/mol
SMILES	COC(=O)c1ccccc1O
InChIKey	OSWPMRLSEDHDFF-UHFFFAOYSA-N
PubChem CID	4133
ChEMBL	CHEMBL108545
ChEBI	CHEBI:31832
EC No.	204-317-7
DTXSID	DTXSID5025659
現地名	ヒメコウジ葉油

化学・物理的性質

XLogP	2.3
極性表面積	46.5
水素結合供与体数	1
水素結合受容体数	3
回転可能結合数	2
重原子数	11
形式電荷	0
複雑度	144
物質分類	Other Uses -> SunscreensWaste-water effluent contaminant
医薬品	Pharmaceuticals -> Listed in ZINC15
化粧品	Cosmetics ingredient -> FlavorFragranceCosmetic ingredients (Methyl Salicylate) -> CIR (Cosmetic Ingredient Review)TonicDenaturantSkin conditioningSoothing
SpringerMaterials Properties	13C nuclear magnetic resonance spectrum
香料	Fragrance Ingredient (Methyl salicylate) -> IFRA transparency List
LogP（分配係数）	Log Kow = 2.552.08
臭い	LIQUID HAVING THE CHARACTERISTIC ODOR OF WINTERGREEN100.00%で。ウィンターグリーンミント
味	LIQUID HAVING THE CHARACTERISTIC TASTE OF WINTERGREEN
食品添加物	FLAVORING AGENT OR ADJUVANT -> FDA Substance added to food
密度	1.174 (USCG, 1999) - Denser than waterwill sink1.184 @ 25 °C/25 °CDENSITY OF NATURAL ESTER IS ABOUT 1.180Relative density (water = 1): 1.181.176-1.1851.184 @25 °C1.181 g/mL at 25 °C(lit.)
香味料	EU Flavoring substances
Viscosity	1.535 mPa*s at 25 °C
FEMA	3112 \| WINTERGREEN EXTRACT (GAULTHERIA PROCUMBENS L.)
引火点	96℃
貯蔵条件	2-8°C
においのタイプ	ミント系
沸点	219°C(lit.)
化粧品成分の機能	スキンコンディショニングトニック香料香料

安全性と法規制

GHS 分類	WarningH302: Harmful if swallowed [Warning Acute toxicity, oral]P203, P261, P264, P270, P272, P273, P280, P301+P317, P302+P352, P318, P321, P330, P333+P317, P362+P364, P405, and P501 (click each P-code to see the statement)This chemical does not meet GHS hazard criteria for 0.3% (6 of 2210) of reports.H302 (96.9%): Harmful if swallowed [Warning Acute toxicity, oral]
規制情報	Chemical: Benzoic acid, 2-hydroxy-, methyl esterChemical: Gaultheria procumbens, ext.Hazard Traits - Fragrance AllergenCommission Regulation (EC) No 1565/2000 (Repealed by Com. Implementing Reg. (EU) No 872/2012)Benzoic acid, 2-hydroxy-, methyl ester is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of Benzoic acid, 2-hydroxy-, methyl ester are required to report information about their production and use of this chemical to the EPA under the Toxic Substances Control Act (TSCA). (40 eCFR Part 711)Status: Active Update: 17-05-2023 https://echa.europa.eu/registration-dossier/-/registered-dossier/2227
火災危険	This chemical is combustible. (NTP, 1992)
火災の可能性	SLIGHT, WHEN EXPOSED TO HEAT OR FLAMECAN REACT WITH OXIDIZING MATERIALS.
健康有害性	Harmful if swallowed, inhaled, absorbed through skin. Vapor mist is irritating to the eyes, mucous membranes, upper respiratory tract and skin. Ingestion of relatively small amount causes severe poisoning and death. Causes nausea, vomiting, acidosis, pulmonary edema, pneumonia, convulsions and death. (USCG, 1999)
有害性の概要	A skin and eye irritantCan be absorbed through skinMay have CNS adverse effects[ICSC] A skin, eye, mucous membrane, and upper respiratory tract irritant[CAMEO] A skin and eye irritant[eChemPortal: ERMA] Included in list of established contact allergens in humans[EC: Scientific Committee on Consumer Safety: Fragrance allergens in cosmetic products (2011)] An irritantMay cause skin sensitizationEffects in poisoning cases include disturbance of acid-base balance, convulsions, and coma[MSDSonline] See Acetylsalicylic acid.