3-브로모메틸-3-메틸옥세탄

Oxetane, 3-(bromomethyl)-3-methyl-

HCID 144860CAS 78385-26-9

부분 구조 검색 유사 구조 찾기

기본 정보

표준 SMILES: CC1(CBr)COC1
InChIKey: MGBZKWOJRYGRTO-UHFFFAOYSA-N
분자식: C5H9BrO
평균 분자량: 165.03 g/mol
단동위원소 질량: 163.98367701

이름 및 식별자

우선 이름: Oxetane, 3-(bromomethyl)-3-methyl-
IUPAC: 3-(bromomethyl)-3-methyloxetane
현지명: 3-브로모메틸-3-메틸옥세탄
영어명: 3-Bromomethyl-3-methyloxetane
분자식: C5H9BrO
분자량: 165.03

이름 및 동의어

3-(bromomethyl)-3-methyloxetane78385-26-9Oxetane, 3-(bromomethyl)-3-methyl-Oxetane, 3-bromomethyl-3-methyl-DTXSID2074409RefChem:857117DTXCID1048122675-615-63-Bromomethyl-3-methyloxetaneMFCD026842903-bromomethyl-3-methyl oxetane3-(bromomethyl)-3-methyl-oxetane

이름 더 보기

3-브로모메틸-3-메틸옥세탄BUTTPARK 89\10-223-Bromomethyl-3-methyloxe...3-Bromomethyl-3-methyl-1-oxetane3-(Bromomethyl)-3-methyloxetane. (BMO)3-Bromomethyl-3-methyloxetane - [B0548]Oxetane, 3-(bromomethyl)-3-methyl- (9CI)2-(Bromomethyl)-2-methyl-1,3-epoxypropane

A839406AKOS006276628GS-4540SY008845EN300-3075073-methyl-3-bromomethyloxetaneSCHEMBL2541533-bromomethyl-3-methyl-oxetane

데이터베이스 식별자

CAS: 78385-26-9
PubChem CID: 144860
DTXSID: DTXSID2074409
EC Number: 675-615-6
Nikkaji: J1.781.489C

물성

구조 계산 물성

XLogP: 1.3
극성 표면적: 9.2 Å²
수소 결합 공여자 수: 0
수소 결합 수용자 수: 1
회전 가능 결합 수: 1
무거운 원자 수: 7
형식 전하: 0
복잡도: 68.5

물리화학적 성질

끓는 점: 162 ℃ · 162℃
밀도: 1.438 · 1.438
굴절률: 1.48 to · 1.4800 to 1.4840
인화점: 62 ℃ · 62℃
저장 조건: 2 · under inert gas (nitrogen or Argon) at 2-8°C
물리적 상태: solid
색상: 무색~연황색
InChI: InChI=1S/C5H9BrO/c1-5(2-6)3-7-4-5/h2-4H2,1H3
InChIKey: MGBZKWOJRYGRTO-UHFFFAOYSA-N
SMILES: O1CC(CBr)(C)C1
EPA: 3 · Oxetane, 3-(bromomethyl)-3-methyl- (78385-26-9)

안전 및 규제

GHS 분류

GHS Classification · 4건

Warning

H302 (95.1%): Harmful if swallowed [Warning Acute toxicity, oral]

P264, P270, P301+P317, P330, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 41 reports by companies from 4 notifications to the ECHA C&L Inventory.

유해성 정보

Regulatory InformationPMN - indicates a commenced PMN (Pre-Manufacture Notices) substance.

Hazard Classes and CategoriesAcute Tox. 4 (95.1%)

안전 데이터

wgk: WGK 3
tsca: TSCA listed
HS 번호: 2932990090
risk_code: 22
hazard_code: Xn
Hazard Classifications: Acute Tox. 4 Oral
스토리지 클래스: 11 - Combustible Solids

화학 및 산업

용도 및 제조

General Manufacturing InformationOxetane, 3-(bromomethyl)-3-methyl-: ACTIVE

상·하류 제품 정보

상류 원료

공급사50 곳

上海康恩博医药科技有限公司17510465506 · [email protected]

陕西凯尔凯医药科技有限公司029-2148545164 17392779578 · [email protected]

陕西格列弗生物科技研究有限责任公司13892423764 · [email protected]

上海凌富药物研究有限公司+86(21)5895 0110 19945755304 · [email protected]

上海麦克林生化科技股份有限公司021-50706066 15221275939 · [email protected]

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