Cholest-5-en-3-ol (3beta)-, 3-(carbonochloridate)

HCID 111262

노트 반응

부분 구조 검색 유사 구조 찾기

기본 정보

CAS: 7144-08-3
표준 SMILES: CC(C)CCC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H](OC(=O)Cl)CC[C@]4(C)[C@H]3CC[C@]12C
InChIKey: QNEPTKZEXBPDLF-JDTILAPWSA-N
분자식: C28H45ClO2
평균 분자량: 449.1 g/mol
단동위원소 질량: 448.31080836

이름 및 식별자

우선 이름: Cholest-5-en-3-ol (3beta)-, 3-(carbonochloridate)
IUPAC: [(3S,8S,9S,10R,13R,14S,17R)-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] carbonochloridate
영어명: Cholesteryl chloroformate
분자식: C28H45ClO2
분자량: 449.12

이름 및 동의어

Cholesteryl chloroformate7144-08-3Cholesterol chloroformateCholesterol, chloroformateCholesteryloxycarbonyl chlorideEINECS 230-447-9NSC 59689Cholest-5-en-3-ol (3beta)-, carbonochloridateCholest-5-en-3-ol (3beta)-, 3-(carbonochloridate)RefChem:576038Cholesterol, chloroformate (8CI)Cholest-5-en-3-ol (3.beta.)-, 3-(carbonochloridate)

이름 더 보기

carbonochloridate(3S,8S,9S,10R,13R,14S,17R)-10,13-Dimethyl-17-((R)-6-methylheptan-2-yl)-2,3,4,7,8,9,10,11,12,13,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-yl carbonochloridateesteryLAcid Cholesterol EsterCholesteryl chloroformate,97%5-CHOLESTEN-3β-OL CHLOROFORMATECholest-5-en-3β-ol chloroformate3β-(Chloroformyloxy)cholest-5-ene

MFCD00003633Chloroformic Acid Cholesterol EsterCholest-5-en-3-ol (3.beta.)-, carbonochloridateCholest-5-ene-3-beta-yl chloroformatecholesterol chlorocarbonate3-Cholesteryl chloroformateSCHEMBL26003Cholesteryl chloroformate, 95%

데이터베이스 식별자

CAS: 7144-08-3
PubChem CID: 111262
DTXSID: DTXSID60880724
EC Number: 230-447-9
Nikkaji: J52.263E

물성

구조 계산 물성

XLogP: 10.2
극성 표면적: 26.3 Å²
수소 결합 공여자 수: 0
수소 결합 수용자 수: 2
회전 가능 결합 수: 7
무거운 원자 수: 31
형식 전하: 0
복잡도: 699

물리화학적 성질

녹는점: 115 · 115-117 °C (lit.)
끓는 점: 556.35 °C · 556.35°C (rough estimate)
밀도: 0.9344 · 0.9344 (rough estimate)
굴절률: 1.533 · 1.5330 (estimate)
저장 조건: Inert atmosphere,Room Temperature
용해도: 천천히 가수분해됨
물리적 상태: 결정성 분말
색상: 흰색에서 황백색까지
수용성: 천천히 가수분해됨
BRN: 3223154 · 3223154
InChIKey: QNEPTKZEXBPDLF-JDTILAPWSA-N
SMILES: CC(C)CCC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@H](CC[C@]4(C)[C@H]3CC[C@]12C)OC(Cl)=O
EPA: -5 · Cholest-5-en-3-ol (3.beta.)-, carbonochloridate (7144-08-3)

화학적 성질

white to off-white crystalline powder

안전 및 규제

GHS 분류

GHS Classification · 4건

Danger

H314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]

P260, P264, P280, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P321, P363, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 47 reports by companies from 4 notifications to the ECHA C&L Inventory.

유해성 정보

Hazard Classes and CategoriesSkin Corr. 1C (100%)

안전 데이터

wgk: 3
tsca: TSCA listed
ridadr: UN 3261 8/PG 2
HS 번호: 29159020
risk_code: 34
hazard_code: C
safety_code: 26-36/37/39-45
포장분류: II
위험 등급: 8
F 고인화성물질: 10-21
Hazard Classifications: Skin Corr. 1B
스토리지 클래스: 8A - Combustible corrosive hazardous materials

화학 및 산업

용도 및 제조

General Manufacturing InformationCholest-5-en-3-ol (3.beta.)-, 3-(carbonochloridate): ACTIVE

응용 분야

용도Cholesteryl chloroformate is used in the preparation of hydrophobized chitosan oligosaccharide, which finds application as an efficient gene carrier. It acts as an initiator in the polymerization of methyl methacrylate.

공급사93 곳

梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]

上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]

武汉鹏垒生物科技有限公司15871464247 · [email protected]

合肥翰刚医药科技有限公司+8618062405514 · [email protected]

上海毕得医药科技股份有限公司400-1647117 13681763483 · [email protected]

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