기본 정보
- CAS
26654-39-7- 표준 SMILES
CC1(C)COC(=O)N1- InChIKey
SYARCRAQWWGZKY-UHFFFAOYSA-N- 분자식
- C5H9NO2
- 평균 분자량
- 115.13 g/mol
- 단동위원소 질량
- 115.06332853
이름 및 식별자
- 우선 이름
- 4,4-Dimethyl-1,3-oxazolidin-2-one
- IUPAC
- 4,4-dimethyl-1,3-oxazolidin-2-one
- 현지명
- 4,4-디메틸-2-옥사졸리디논
- 영어명
- 4,4-DIMETHYL-2-OXAZOLIDINONE
- 분자식
- C5H9NO2
- 분자량
- 115.13
이름 및 동의어
26654-39-74,4-Dimethyl-1,3-oxazolidin-2-one4,4-Dimethyl-2-oxazolidinone2-Oxazolidinone, 4,4-dimethyl-LO6MA6GT2SNSC 489112-Oxazolidinone,4,4-dimethyl-UNII-LO6MA6GT2SDTXSID2074617NSC-48911DIMETHYL-2-OXAZOLIDINONE, 4,4-RefChem:96352
이름 더 보기
4,4-디메틸-2-옥사졸리디논DMODMRTA14,4-Dimethyloxazolidinone4,4-dimethyl-oxazolidin-2...4,4-dimethyl-oxazolidine-2-one
DTXCID9037539834-980-3SYARCRAQWWGZKY-UHFFFAOYSA-N4,4-dimethyloxazolidin-2-one4,4-DIMETHYL-OXAZOLIDIN-2-ONEMFCD04038702NSC489114-Dimethyl-2-oxazolidon
데이터베이스 식별자
- CAS
26654-39-7- PubChem CID
- 141315
- DTXSID
DTXSID2074617- UNII
- LO6MA6GT2S
- EC Number
- 834-980-3
- Nikkaji
- J1.510.537B
물성
구조 계산 물성
- XLogP
- 0.3
- 극성 표면적
- 38.3 Ų
- 수소 결합 공여자 수
- 1
- 수소 결합 수용자 수
- 2
- 회전 가능 결합 수
- 0
- 무거운 원자 수
- 8
- 형식 전하
- 0
- 복잡도
- 120
물리화학적 성질
- 녹는점
- 55 · 55-56 °C(Solv: ethanol (64-17-5); ligroine (8032-32-4))
- 끓는 점
- 152 · 152-154 °C(Press: 10 Torr)
- 밀도
- 1.039 · 1.039±0.06 g/cm3(Predicted)
- 저장 조건
- Sealed in dry,Room Temperature
- 물리적 상태
- 고체
- 산도 계수 (pKa)
- 12.91 · 12.91±0.40(Predicted)
- 색상
- 흰색에서 황백색까지
- InChI
- 1S/C5H9NO2/c1-5(2)3-8-4(7)6-5/h3H2,1-2H3,(H,6,7)
- InChIKey
- SYARCRAQWWGZKY-UHFFFAOYSA-N
- SMILES
- CC1(C)COC(=O)N1
- EPA
- 2 · 2-Oxazolidinone, 4,4-dimethyl- (26654-39-7)
안전 및 규제
GHS 분류
GHS Classification
Warning
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation];H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation];H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
유해성 정보
Regulatory InformationPMN - indicates a commenced PMN (Pre-Manufacture Notices) substance.
Hazard Classes and CategoriesSkin Irrit. 2 (100%);Eye Irrit. 2A (100%);STOT SE 3 (100%)
규제 정보
Regulatory InformationPMN - indicates a commenced PMN (Pre-Manufacture Notices) substance.
안전 데이터
- wgk
- 3
- tsca
- TSCA listed
- HS 번호
- 2934999090
- 스토리지 클래스
- 11 - Combustible Solids
화학 및 산업
용도 및 제조
General Manufacturing Information2-Oxazolidinone, 4,4-dimethyl-: ACTIVE
상·하류 제품 정보
상류 원료
공급사54 곳
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