기본 정보
- CAS
4435-53-4- 표준 SMILES
COC(C)CCOC(C)=O- InChIKey
QMYGFTJCQFEDST-UHFFFAOYSA-N- 분자식
- C7H14O3
- 평균 분자량
- 146.18 g/mol
- 단동위원소 질량
- 146.0942943
개요
Butoxyl appears as a liquid with an acrid odor. Flash point near 140 °F. Slightly less dense than water. Vapors much heavier than air. May irritate skin, eyes, and mucous membranes.
이름 및 식별자
- 우선 이름
- 3-Methoxybutyl acetate
- IUPAC
- 3-methoxybutyl acetate
- 현지명
- 3-메톡시부틸 아세테이트
- 영어명
- 3-Methoxybutyl acetate
- 분자식
- C7H14O3
- 분자량
- 146.18
이름 및 동의어
3-METHOXYBUTYL ACETATE4435-53-4ButoxylAcetic Acid 3-Methoxybutyl Ester1-Butanol, 3-methoxy-, acetate3-Methoxy-1-butyl acetateAcetic acid, 3-methoxybutyl esterMethyl-1,3-butylene glycol acetate3-methoxy-n-butyl acetate2W0NXC23XWNSC-15638DTXSID2052106
이름 더 보기
3-메톡시부틸아세테이트부톡실3-메톡시부틸아세트산부톡실아세트산3-메톡시부틸에스테르3-메톡시-1-부탄올에스테르뷰톡실MethoxybutyMethoxybutyl Este5-methoxyhexanoatemethoxybutyl acetate3-Methoxy-n-butylacetat3-methoxybutyl ethanoate3-methoxy-1-butanoacetate
RefChem:571618DTXCID4030673224-644-93-Methoxybutyl Ester1-Butanol, 3-methoxy-, 1-acetate3-Methoxybutylester kyseliny octoveMFCD00043928EINECS 224-644-9
데이터베이스 식별자
- CAS
물성
구조 계산 물성
- XLogP
- 0.8
- 극성 표면적
- 35.5 Ų
- 수소 결합 공여자 수
- 0
- 수소 결합 수용자 수
- 3
- 회전 가능 결합 수
- 5
- 무거운 원자 수
- 10
- 형식 전하
- 0
- 복잡도
- 101
실험 및 물리화학적 성질
Chemical ClassesFlammable agents - 2nd degree
Density0.96 (USCG, 1999) - Less dense than water; will float
Flash Point170 °F (USCG, 1999)
Boiling Point275 °F at 760 mmHg (USCG, 1999)
Physical DescriptionButoxyl appears as a liquid with an acrid odor. Flash point near 140 °F. Slightly less dense than water. Vapors much heavier than air. May irritate skin, eyes, and mucous membranes.
물리화학적 성질
- 끓는 점
- 172 °C · 172 °C
- 밀도
- 0 · 0,96 g/cm3
- 굴절률
- 1.407 · 1.4070-1.4090
- 인화점
- 62 °C · 62°C
- 물리적 상태
- 투명한 액체
- 색상
- 무색의
- 수용성
- 60.68 g/L · 60.68g/L(20℃)
- InChI
- InChI=1S/C7H14O3/c1-6(9-3)4-5-10-7(2)8/h6H,4-5H2,1-3H3
- InChIKey
- QMYGFTJCQFEDST-UHFFFAOYSA-N
안전 및 규제
안전 정보는 참고용이며, 공급업체의 물질안전보건자료(SDS), 관련 법규 및 전문가 평가를 대체하지 않습니다.
GHS 분류
GHS Classification
This chemical does not meet GHS hazard criteria for 59.2% (355 of 600) of all reports.
Warning
H336 (35.3%): May cause drowsiness or dizziness [Warning Specific target organ toxicity, single exposure; Narcotic effects]
P261, P271, P304+P340, P319, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 600 reports by companies from 7 notifications to the ECHA C&L Inventory.
유해성 정보
Regulatory Information
Chemical: 1-Butanol, 3-methoxy-, acetate
1-Butanol, 3-methoxy-, 1-acetate is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of 1-Butanol, 3-methoxy-, 1-acetate 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)
REACH registered substance: 3-methoxybutyl acetate (EC: 224-644-9)
1-Butanol, 3-methoxy-, acetate: HSNO Approval: HSR001077 Approved with controls
The New Jersey Worker and Community Right to Know Act requires public and private employers to provide information about hazardous substances at their workplaces. (N.J.S.A. 34:5A-1 et. seq.)
DOT LabelFlammable Liquid
Fire HazardsSpecial Hazards of Combustion Products: When heated to decomposition, emits acrid smoke and irritating fumes. (USCG, 1999)
Health HazardsCauses eye and skin irritation. Mildly toxic by ingestion. (USCG, 1999)
Reactive GroupEsters, Sulfate Esters, Phosphate Esters, Thiophosphate Esters, and Borate Esters
EPA Safer ChemicalChemical: 3-Methoxybutyl acetate
화학 및 산업
용도 및 제조
U.S. Production2022: 2,181 lb
Use Classification
EPA Safer Chemical Functional Use Classes -> Solvents
Safer Chemical Classes -> Green circle - The chemical has been verified to be of low concern
General Manufacturing Information1-Butanol, 3-methoxy-, 1-acetate: ACTIVE
응용 분야
일반 설명A liquid with an acrid odor. Flash point near 140°F. Slightly less dense than water. Vapors much heavier than air. May irritate skin, eyes, and mucous membranes.
공급사93 곳
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