디에틸(3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,10-헵타데카플루오로덱-1-일)포스포네이트

Diethyl 3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,10-heptadecafluorodecylphosphonate

HCID 12175336

노트 반응

부분 구조 검색 유사 구조 찾기

기본 정보

CAS: 90146-96-6
표준 SMILES: CCOP(=O)(CCC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F)OCC
InChIKey: GYIWCCQPZCEECI-UHFFFAOYSA-N
분자식: C14H14F17O3P
평균 분자량: 584.2 g/mol
단동위원소 질량: 584.04091068

이름 및 식별자

우선 이름: Diethyl 3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,10-heptadecafluorodecylphosphonate
IUPAC: 10-diethoxyphosphoryl-1,1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8-heptadecafluorodecane
현지명: 디에틸(3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,10-헵타데카플루오로덱-1-일)포스포네이트
영어명: Diethyl (3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,10-heptadecafluorodec-1-yl)phosphonate
분자식: C14H14F17O3P
분자량: 584.21

이름 및 동의어

90146-96-6diethyl 3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,10-heptadecafluorodecylphosphonateDTXSID00479232RefChem:337861DTXCID20430042DIETHYL (1H,1H,2H,2H-HEPTADECAFLUORODEC-1-YL)PHOSPHONATEMFCD19105611Diethyl(3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,10-heptadecafluorodec-1-yl)phosphonateSCHEMBL3486992C14H14F17O3Pdiethyl (3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,10-heptadecafluorodecyl)phosphonateNS00108807

이름 더 보기

디에틸(3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,10-헵타데카플루오로덱-1-일)포스포네이트10-diethoxyphosphoryl-1,1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8-heptadecafluorodecaneDiethyl (3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,10-heptadecafluorodec-1-yl)phosphonatePhosphonic acid, P-(3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,10-heptadecafluorodecyl)-, diethyl ester

10-diethoxyphosphoryl-1,1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8-heptadecafluoro-decaneDiethyl-3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,10-heptadecafluorodecylphosphonate

데이터베이스 식별자

CAS: 90146-96-6
PubChem CID: 12175336
DTXSID: DTXSID00479232
Nikkaji: J1.639.462I

물성

구조 계산 물성

XLogP: 6.4
극성 표면적: 35.5 Å²
수소 결합 공여자 수: 0
수소 결합 수용자 수: 20
회전 가능 결합 수: 13
무거운 원자 수: 35
형식 전하: 0
복잡도: 766

실험 및 물리화학적 성질

PFAS · 2건

PFAS -> Other/unspecified

PFAS -> OECD Category

물리화학적 성질

EPA: 3 · diethyl 3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,10-heptadecafluorodecylphosphonate (90146-96-6)

화학 및 산업

용도 및 제조

Use ClassificationPFAS (per- and polyfluoroalkyl substances) -> OECD Category

공급사2 곳

SYNQUEST[email protected]

APOLLO-NMR[email protected]

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