기본 정보
- CAS
497-26-7- 표준 SMILES
CC1OCCO1- InChIKey
HTWIZMNMTWYQRN-UHFFFAOYSA-N- 분자식
- C4H8O2
- 평균 분자량
- 88.11 g/mol
- 단동위원소 질량
- 88.05242949
이름 및 식별자
- 우선 이름
- 2-Methyl-1,3-dioxolane
- IUPAC
- 2-methyl-1,3-dioxolane
- 현지명
- 2-메틸-1,3-디옥솔란
- 영어명
- 2-Methyl-1,3-dioxolane
- 분자식
- C4H8O2
- 분자량
- 88.11
이름 및 동의어
2-METHYL-1,3-DIOXOLANE497-26-71,3-Dioxolane, 2-methyl-2-MethyldioxolaneMethyl dioxolane2-Methyl-1,3-dioxacyclopentanecisdioxocis-methyldioxolane94W0R6V90ANSC-5209DTXSID7060095RefChem:87967
이름 더 보기
2-메틸-1,3-다이옥솔레인2-메틸-1,3-디옥솔란2-Methyl-1,3-dioxaneRARECHEM AL BP 05442-methyl-3-dioxolane2-Methyl-1,3-dioxolane>2-METHYL-1,3-DIOXOLANE 98+%
DTXCID3040720207-841-42-MethyldioxoleMethyldioxolaneAcetaldehyde ethylene acetalDioxolane, methyl-Methyl-1,3-dioxolaneMFCD00003210
데이터베이스 식별자
- CAS
497-26-7- PubChem CID
- 10342
- DTXSID
DTXSID7060095- ChEMBL
CHEMBL5266581- UNII
- 94W0R6V90A
- EC Number
- 207-841-4
- Nikkaji
- J25.401K
물성
구조 계산 물성
- XLogP
- 0.2
- 극성 표면적
- 18.5 Ų
- 수소 결합 공여자 수
- 0
- 수소 결합 수용자 수
- 2
- 회전 가능 결합 수
- 0
- 무거운 원자 수
- 6
- 형식 전하
- 0
- 복잡도
- 38.8
실험 및 물리화학적 성질
SpringerMaterials PropertiesSchoenflies notation
물리화학적 성질
- 끓는 점
- 82 · 82-83 °C (lit.)
- 밀도
- 0.982 g/mL · 0.982 g/mL at 25 °C (lit.)
- 굴절률
- 20 · n20/D 1.398(lit.)
- 인화점
- 28 °F · 28 °F
- 저장 조건
- Flammables area
- 수용성
- Completely miscible in water
- 물리적 상태
- 액체
- 색상
- 무색 내지 거의 무색
- 폭발한계
- 1.8 % · 1.8%(V)
- BRN
- 102520 · 102520
- Henry's Law Constant
- 7.9 · 7.9×10-1 mol/(m3Pa) at 25℃, Ebert et al. (2023)
- InChI
- 1S/C4H8O2/c1-4-5-2-3-6-4/h4H,2-3H2,1H3
- InChIKey
- HTWIZMNMTWYQRN-UHFFFAOYSA-N
- SMILES
- CC1OCCO1
- EPA
- 2 · 2-Methyl-1,3-dioxolane (497-26-7)
안전 및 규제
안전 정보는 참고용이며, 공급업체의 물질안전보건자료(SDS), 관련 법규 및 전문가 평가를 대체하지 않습니다.
GHS 분류
GHS Classification
Danger
H225 (100%): Highly Flammable liquid and vapor [Danger Flammable liquids]
P210, P233, P240, P241, P242, P243, P264+P265, P280, P303+P361+P353, P305+P351+P338, P337+P317, P370+P378, P403+P235, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 166 reports by companies from 5 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
유해성 정보
Hazard Classes and CategoriesFlam. Liq. 2 (100%)
안전 데이터
- wgk
- 2
- tsca
- TSCA listed
- rtecs
- JI3509000
- ridadr
- UN 1993 3/PG 2
- HS 번호
- 29329990
- risk_code
- 11-36
- hazard_code
- F,Xi
- safety_code
- 16-26
- 포장분류
- II
- 위험 등급
- 3
- Hazard Classifications
- Flam. Liq. 2
- 스토리지 클래스
- 3 - Flammable liquids
화학 및 산업
약리 정보
MeSH Pharmacological Classification
Drugs that mimic the effects of parasympathetic nervous system activity. Included here are drugs that directly stimulate muscarinic receptors and drugs that potentiate cholinergic activity, usually by slowing the breakdown of acetylcholine (CHOLINESTERASE INHIBITORS). Drugs that stimulate both sympathetic and parasympathetic postganglionic neurons (GANGLIONIC STIMULANTS) are not included here.
용도 및 제조
General Manufacturing Information1,3-Dioxolane, 2-methyl-: ACTIVE
응용 분야
용도2-Methyl-1,3-dioxolane is used in method for treating biodegradation of organic chlorine compounds using 1,4-Dioxane-degrading bacterium N23 strain.
일반 설명The kinetics and mechanism of the gas-phase thermal decomposition of 2-methyl-1,3-dioxolane has been studied in a static system. The infrared spectra of solid, liquid and gaseous 2-methyl-1,3-dioxolane has been studied. Low-temperature ozonation of 2-methyl-1,3-dioxolane in acetone-d6, methyl acetate and tert-butyl methyl ether has been reported.
상·하류 제품 정보
상류 원료
관련 반응
6건
화합물 노트
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