홈MCP워크벤치Skills
홈워크벤치알림마이페이지
Huagongshe 오픈 프로젝트:[email protected]AI 접속: llms.txt · MCP 가이드개인정보처리방침 · 이용약관 · 지원v1.7.8
돌아가기
Huagongshe화공사 화학 정보 인쇄 보고서 · 연구 참고용
HCID 8181생성일: 2026년 10월 27일

Methyl Palmitate

https://huagongshe.com/ko/chemical/8181

Methyl Palmitate 분자 구조식

식별자 및 물리적 특성

CAS No.112-39-0
분자식C17H34O2
평균 분자량270.5 g/mol
단동위원소 질량270.25588033 g/mol
SMILESCCCCCCCCCCCCCCCC(=O)OC
InChIKeyFLIACVVOZYBSBS-UHFFFAOYSA-N
PubChem CID8181
ChEMBLCHEMBL335125
ChEBICHEBI:69187
EC No.203-966-3
DTXSIDDTXSID4029149

화학 및 물리적 성질

XLogP7.9
극성 표면적26.3
수소 결합 공여자 수0
수소 결합 수용자 수2
회전 가능 결합 수15
무거운 원자 수19
형식 전하0
복잡도190
물질 분류Biological Agents -> Plant Oils and Extracts
지질Fatty Acyls [FA] -> Fatty esters [FA07] -> Short fatty esters [FA0710]
화장품Skin conditioningEmollient
SpringerMaterials PropertiesBoiling point
향료Fragrance Ingredient (Methyl hexadecanoate) -> IFRA transparency List
LogP(분배 계수)log Kow= 7.38
향미제EU Flavoring substances
Color/FormColorless liq
용해도Insol in watervery sol in ethyl alc, acetonesol in etherInsoluble in water, soluble in alcohol and ether
끓는 점417 °C
녹는점30 °C
증기압0.0000604 [mmHg]6.04X10-5 @ 25 °C

안전 및 규제

GHS 분류This chemical does not meet GHS hazard criteria for 5.9% (99 of 1667) of reports.WarningH315 (82.7%): Causes skin irritation [Warning Skin corrosion/irritation]P261, P264, P272, P280, P302+P352, P321, P332+P317, P333+P317, P362+P364, and P501 (click each P-code to see the statement)Aggregated GHS information provided per 1667 reports by companies from 5 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
규제 정보Chemical: Hexadecanoic acid, methyl esterCommission Regulation (EC) No 1565/2000 (Repealed by Com. Implementing Reg. (EU) No 872/2012)Hexadecanoic acid, methyl ester is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of Hexadecanoic acid, 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: 27-03-2018 https://echa.europa.eu/registration-dossier/-/registered-dossier/15817Methyl palmitate: Does not have an individual approval but may be used under an appropriate group standard
기타 안전 정보IMAP assessments - Hexadecanoic acid, methyl ester: Human health tier I assessment
유해성 요약May cause irritation[MSDSonline]
Hazard Classes and CategoriesSkin Irrit. 2 (82.7%)
처리 방법SRP: At the time of review, criteria for land treatment or burial (sanitary landfill) disposal practices are subject to significant revision. Prior to implementing land disposal of waste residue (including waste sludge), consult with environmental regulatory agencies for guidance on acceptable disposal practices.
체내 부담Methyl palmitate was detected in thrombogenic coronary plaques in 2 of 2 human aortas samples at 9 and 120 ppb(1).
상호 작용METHYL PALMITATE, AN INHIBITOR OF RETICULOENDOTHELIAL SYSTEM (RES) FUNCTION, INHIBITED BOTH THE RES FUNCTION & SERUM LYSOZYME INCREASES WHEN ADMIN TO GLUCAN TREATED MICE.GLUCAN-TREATED, ENDOTOXIN-SENSITIVE RATS ADMIN METHYL PALMITATE, A RETICULOENDOTHELIAL DEPRESSANT WHICH RENDERS RATS ENDOTOXIN RESISTANT, FOLLOWED BY SALMONELLA ENTERITIDIS ENDOTOXIN, RESULTED IN ENHANCED ELEVATION OF PLASMA GLUTAMIC OXALACETIC TRANSAMINASE & HYPOGLYCEMIA.THE VASCULAR REMOVAL & ORGAN UPTAKE OF INCOMPATIBLE SHEEP RED CELLS LABELED WITH CHROMIUM IN MICE WAS DECR DUE TO DECR VASCULAR CLEARANCE CAUSED BY FAILURE IN PHAGOCYTOSIS BY BOTH LIVER & SPLEEN AFTER ADMIN OF METHYL PALMITATE, A RETICULOENDOTHELIAL DEPRESSANT.THE ADMIN OF METHYL PALMITATE 100 MG/100 G, IV TO RATS CAUSED AN INCR IN SURVIVAL AT ENDOTOXIN DOSES OF 0.75 TO 3.0 MG/100 G. ALTHOUGH A MEAN 38% MORTALITY WAS CAUSED BY SALMONELLA ENTERITIDIS ENTOXIN 0.5 MG/100 G, IV IN NORMAL RATS , A 6-FOLD INCR OF THIS DOSE DID NOT CAUSE MORTALITY IN THE METHYL PALMITATE GROUP. METHYL PALMITATE, WHEN ADMIN TO GLUCAN-TREATED RATS, CAUSED NORMAL PHAGOCYTIC ACTIVITY IN THE PRESENCE OF RETICULOENDOTHELIAL SYSTEM HYPERTROPHY.For more Interactions (Complete) data for METHYL PALMITATE (8 total), please visit the HSDB record page.
환경 거동TERRESTRIAL FATE: Based on a classification scheme(1), an estimated Koc value of 18,000(SRC), determined from a structure estimation method(2), indicates that methyl palmitate is expected to be immobile in soil(SRC). Volatilization of methyl palmitate from moist soil surfaces is expected to be an important fate process(SRC) given an estimated Henry's Law constant of 0.009 atm-cu m/mole(SRC), using a fragment constant estimation method(3). However, adsorption to soil is expected to attenuate volatilization(SRC). Methyl palmitate is not expected to volatilize from dry soil surfaces(SRC) based upon a vapor pressure of 0.00006 mm Hg(4). Methyl palmitate is expected to rapidly biodegrade in aerobic soils based on the results of screening studies(5).AQUATIC FATE: Based on a classification scheme(1), an estimated Koc value of 18,000(SRC), determined from an estimation method(2), indicates that methyl palmitate is expected to adsorb to suspended solids and sediment in water(SRC). Volatilization from water surfaces is expected(3) based upon an estimated Henry's Law constant of 0.009 atm-cu m/mole(SRC), developed using a fragment constant estimation method(4). Volatilization half-lives for a model river and model lake are 5 and 160 hours, respectively(SRC), using an estimation method(3). However, volatilization from water surfaces is expected to be attenuated by adsorption to suspended solids and sediment in the water column(SRC). The volatilization half-life from a model pond is estimated to be about 60 hours ignoring adsorptionwhen considering maximum adsorption the volatilization half-life increases to 150 days(5). According to a classification scheme(6), an estimated BCF of 620(SRC) from a log Kow of 7.38(10) regression-derived equation(7) suggests the potential for bioconcentration in aquatic organisms is high. Methyl palmitate is expected to rapidly biodegrade in aerobic waters(8). An estimated base-catalyzed second-order hydrolysis rate constant of 0.030 L/mole-sec(9,SRC) corresponds to half-lives of 7.3 years and 270 days at pH values of 7 and 8, respectively(9).ATMOSPHERIC FATE: According to a model of gas/particle partitioning of semivolatile organic compounds in the atmosphere(1), methyl palmitate, which has a vapor pressure of 0.00006 mm Hg at 25 °C(2), will exist in both the vapor and particulate phases in the ambient atmosphere. Vapor-phase methyl palmitate is degraded in the atmosphere by reaction with photochemically-produced hydroxyl radicals(SRC)the half-life for this reaction in air is estimated to be 20 hours(SRC) from its estimated rate constant of 1.9X10-11 cu cm/molecule-sec at 25 °C(3). Particulate-phase methyl palmitate may be removed from the air by wet and dry deposition(SRC).
식품 조사 수치Methyl palmitate was detected as a volatile flavor component of clove essential oil(1). It was identified as a constituent of cassava, gari, farine(2), clams, short neck clams, and corbicula(3).
Effluent ConcentrationsMethyl palmitate was identified in 1 of 3 New Jersey POTW effluents, date not provided, at an estimated concentration of 1 ppb(1). It was detected in 12 of 13 effluent samples from an olive oil production plant, Spain, at 163-15808 ug/l(2).
Soil Adsorption/MobilityUsing a structure estimation method based on molecular connectivity indices(1), the Koc for methyl palmitate can be estimated to be about 18,000(SRC). According to a classification scheme(2), this estimated Koc value suggests that methyl palmitate is expected to be immobile in soil.
Natural Pollution SourcesMethyl palmitate is a component of the flowers of the Japanese honeysuckle (Lonicera japonica)(1). Methyl palmitate has been identified as a component of some food including clove essential oil(2), cassava, gari, farine(3), clams, short neck clams, and corbicula(4).
Artificial Pollution SourcesMethyl palmitate's production and use as an synthetic intermediate(1) may result in its release to the environment through various waste streams(SRC).
Environmental BiodegradationAEROBIC: Methyl palmitate was found to partially biodegrade within 24 hours when inoculated with a mixed activated sludge in a Warburg respirator(1). A close structural analog to methyl palmitate, ethyl palmitate, was found to undergo 44% removal in 5 days when incubated with a sewage sludge seed(2).
Sediment/Soil ConcentrationsSOIL: Methyl palmitate was qualitatively detected in soil samples from Southern Alberta, Canada, in strata associated with the Mazama volcano eruption which occurred approximately 7000 years ago(1). SEDIMENT: Methyl palmitate was qualitatively detected in a sediment sample from the Calcasieu River, LA, 1979(2).
Environmental BioconcentrationAn estimated BCF of 2 was calculated for methyl palmitate (SRC) using a log Kow of 7.38(1) and a regression-derived equation developed for hydrophobic chemicals(2). According to a classification scheme(3), the estimated BCF suggests the potential for bioconcentration in aquatic organisms is low.
Volatilization from Water/SoilThe Henry's Law constant for methyl palmitate is estimated as 0.009 atm-cu m/mole(SRC) using a fragment constant estimation method(1). This Henry's Law constant indicates that methyl palmitate is expected to volatilize from water surfaces(2). Based on this Henry's Law constant, the volatilization half-life from a model river (1 m deep, flowing 1 m/sec, wind velocity of 3 m/sec)(2) is estimated as approximately 5 hours(SRC). The volatilization half-life from a model lake (1 m deep, flowing 0.05 m/sec, wind velocity of 0.5 m/sec)(2) is estimated as approximately 6.5 days(SRC). Methyl palmitate's Henry's Law constant(1) indicates that volatilization from moist soil surfaces may occur(SRC). The volatilization half-life from a model pond 2 m deep is estimated to be about 60 hours ignoring adsorptionwhen considering maximum adsorption the volatilization half-life increases to 150 days(3). Methyl palmitate is not expected to volatilize from dry soil surfaces(SRC) based upon a vapor pressure of 0.00006 mm Hg(4).