4′-포르밀벤조-15-크라운-5

4'-Formylbenzo-15-crown-5

HCID 324243CAS 60835-73-6

부분 구조 검색 유사 구조 찾기

기본 정보

표준 SMILES: O=Cc1ccc2c(c1)OCCOCCOCCOCCO2
InChIKey: MBJIKIAWNPEHOR-UHFFFAOYSA-N
분자식: C15H20O6
평균 분자량: 296.31 g/mol
단동위원소 질량: 296.12598836

이름 및 식별자

우선 이름: 4'-Formylbenzo-15-crown-5
IUPAC: 2,5,8,11,14-pentaoxabicyclo[13.4.0]nonadeca-1(15),16,18-triene-17-carbaldehyde
현지명: 4′-포르밀벤조-15-크라운-5
영어명: 4'-Formylbenzo-15-crown 5-ether
분자식: C15H20O6
분자량: 296.32

이름 및 동의어

4'-Formylbenzo-15-crown 5-Ether4'-Formylbenzo-15-crown-5DTXSID7031482817-Formyl-2,5,8,11,14-pentaoxabicyclo[13.4.0]nonadeca-15,17,19-triene17-Formyl-2,5,8,11,14-pentaoxabicyclo(13.4.0)nonadeca-15,17,19-trieneRefChem:506131DTXCID60265951622-792-260835-73-62,5,8,11,14-pentaoxabicyclo[13.4.0]nonadeca-1(15),16,18-triene-17-carbaldehyde4-FORMYLBENZO-15-CROWN 5-ETHERMFCD00192180

이름 더 보기

4′-포르밀벤조-15-크라운-5Nsc2889234'-Formylbenzo-15-crown5-Ether>3,4-[Oxybis(ethyleneoxyethyleneoxy)]benzaldehyde3,4-(Oxybisethylenebisoxybisethylenebisoxy)benzaldehyde2,3-(4-FORMYLBENZO)-1,4,7,10,13-PENTAOXACYCLOPENTADEC-2-ENE2,3,5,6,8,9,11,12-Octahydro-1,4,7,10,13-benzopentaoxacyclopentadecin-15-carbaldehyde2,5,8,1,14-pentaoxybiscyclo[13.4.0]decanonalkane-1(15),16,18-triene-17-methylaldehyde

2,3,5,6,8,9,11,12-octahydro-1,4,7,10,13-benzopentaoxacyclopentadecine-15-carbaldehydeMLS0031155984'-Formylbenzo-15-crown-5, 97%NSC-288923LS-14422F0448T726952,3,5,6,8,9,11,12-octahydrobenzo[b][1,4,7,10,13]pentaoxacyclopentadecine-15-carbaldehyde

데이터베이스 식별자

CAS: 60835-73-6
PubChem CID: 324243
DTXSID: DTXSID70314828
ChEMBL: CHEMBL2133201
EC Number: 622-792-2
Nikkaji: J352.643G

물성

구조 계산 물성

XLogP: 0.5
극성 표면적: 63.2 Å²
수소 결합 공여자 수: 0
수소 결합 수용자 수: 6
회전 가능 결합 수: 1
무거운 원자 수: 21
형식 전하: 0
복잡도: 285

물리화학적 성질

녹는점: 78 · 78-81 °C(lit.)
끓는 점: 458.3 · 458.3±45.0 °C(Predicted)
밀도: 1.127 · 1.127±0.06 g/cm3(Predicted)
저장 조건: 2 · 2-8°C, stored under nitrogen
물리적 상태: powder to crystal
색상: White to Orange to Green
BRN: 1627198 · 1627198
InChI: 1S/C15H20O6/c16-12-13-1-2-14-15(11-13)21-10-8-19-6-4-17-3-5-18-7-9-20-14/h1-2,11-12H,3-10H2
InChIKey: MBJIKIAWNPEHOR-UHFFFAOYSA-N
SMILES: O=Cc1ccc2OCCOCCOCCOCCOc2c1

안전 및 규제

GHS 분류

GHS Classification · 4건

Warning

H315 (100%): Causes skin irritation [Warning Skin corrosion/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)

Aggregated GHS information provided per 40 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

유해성 정보

Hazard Classes and CategoriesSkin Irrit. 2 (100%)

안전 데이터

wgk: 3
HS 번호: 2932.99.9090
risk_code: 36/37/38
hazard_code: Xi
safety_code: 26-36
Hazard Classifications: Eye Irrit. 2Skin Irrit. 2STOT SE 3
스토리지 클래스: 11 - Combustible Solids

화학 및 산업

상·하류 제품 정보

상류 원료

하류 제품

Benzo-15-crown-5

공급사50 곳

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

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

云南苏理生物医药科技有限公司0871-68355600 18787766125

上海腾准生物科技有限公司19821570922 · [email protected]

焦作沃恩生物科技有限责任公司0391-3702345 18739121806

연결된 노트

불러오는 중…