사이클로부타논

Cyclobutanone

HCID 14496CAS 1191-95-3
부분 구조 검색유사 구조 찾기

기본 정보

표준 SMILES
O=C1CCC1
InChIKey
SHQSVMDWKBRBGB-UHFFFAOYSA-N
분자식
C4H6O
평균 분자량
70.09 g/mol
단동위원소 질량
70.04186481

이름 및 식별자

우선 이름
Cyclobutanone
IUPAC
cyclobutanone
현지명
사이클로부타논
영어명
Cyclobutanone
분자식
C4H6O
분자량
70.09

이름 및 동의어

CYCLOBUTANONE1191-95-3MFCD00001332NSC 876326PF2SH405UNSC-87632cyclobutanoncylcobutanonecylobutanoneUNII-6PF2SH405U3-cyclobutanoneEINECS 214-745-6
이름 더 보기
사이클로부타논CBONobutanoneOxocyclobutane1-OxocyclobutaneCyclobutanone 98%Cyclobutanone, 97%Cyclobutanone, 98+%OS-7558Cyclobutanonecyclobutanone(SALTDATA: FREE)
Cyclobutanone, 99%AI3-37787SCHEMBL276387SCHEMBL290757SCHEMBL388722SCHEMBL9323692DTXSID9061592NSC87632

데이터베이스 식별자

CAS
1191-95-3
PubChem CID
14496
DTXSID
DTXSID9061592
UNII
6PF2SH405U
EC Number
214-745-6
Nikkaji
J80.072D

물성

구조 계산 물성

XLogP
0
극성 표면적
17.1 Ų
수소 결합 공여자 수
0
수소 결합 수용자 수
1
회전 가능 결합 수
0
무거운 원자 수
5

실험 및 물리화학적 성질

Vapor Pressure43.0 [mmHg]
Physical DescriptionColorless liquid; [MSDSonline]
Kovats Retention Index639；641；642；639；641；645；647；633

물리화학적 성질

녹는점
-50.9 °C · -50.9 °C
끓는 점
99 °C · 99 °C (lit.)
밀도
0.938 g/mL · 0.938 g/mL at 25 °C (lit.)
굴절률
20 · n20/D 1.421(lit.)
인화점
50 °F · 50 °F
저장 조건
2 · 2-8°C

화학적 성질

Clear colourless to slightly yellow liquid

안전 및 규제

GHS 분류

GHS Classification · 5건

Danger

H225 (23.2%): Highly Flammable liquid and vapor [Danger Flammable liquids]；H226 (76.8%): Flammable liquid and vapor [Warning Flammable liquids]

P210, P233, P240, P241, P242, P243, P280, P303+P361+P353, P370+P378, P403+P235, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 56 reports by companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.；Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.

유해성 정보

Regulatory InformationCyclobutanone: Does not have an individual approval but may be used under an appropriate group standard
Hazards SummaryMay cause irritation; [MSDSonline] See Cyclohexanone and Cyclopentanone.
Hazard Classes and CategoriesFlam. Liq. 2 (23.2%)；Flam. Liq. 3 (76.8%)

독성 정보

Adverse EffectsNeurotoxin - Acute solvent syndrome

규제 정보

Regulatory InformationCyclobutanone: Does not have an individual approval but may be used under an appropriate group standard

안전 데이터

wgk
3
tsca
TSCA listed
ridadr
UN 1224 3/PG 3
HS 번호
29142900
risk_code
10-11
hazard_code
F,F+

화학 및 산업

용도 및 제조

General Manufacturing InformationCyclobutanone: ACTIVE
응용 분야 · 1건

용도Cyclobutanone is used in preparation of cyclobutane derivatives. It is used as a starting material for aminocyclobutanecarboxylic acid through sulfonyloxiranes. It is also used to prepare dihydro-furan-2-one in presence of polystyrene-bound phenylselenic acid as catalyst. Further, it is involved in the photochemical synthesis of nucleoside analogues such as bicyclic nucleosides and isonucleosides.

제조 방법 · 1건

The Russian chemist Nikolai Kischner first prepared cyclobutanone in 1905. He synthesized cyclobutanone in a low yield from cyclobutanecarboxylic acid in several reaction steps.Another synthesis of cyclobutanone involves lithium-catalyzed rearrangement of oxaspiropentane, which is formed by epoxidation of the easily accessible methylenecyclopropane.

상·하류 제품 정보

공급사50 곳

国药集团化学试剂有限公司86-21-63210123 · [email protected]
梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
衢州润东化工有限公司0570-8789886 18892685668 · [email protected]
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
四川伟博贸易有限公司028-65199188 13880582998 · [email protected]

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