O-(6-Chlorobenzotriazol-1-yl)-N,N,N',N'-tetramethyluronium hexafluorophosphate

HCID 42624899

기본 정보

표준 SMILES
CN(C)C(On1nnc2ccc(Cl)cc21)=[N+](C)C.F[P-](F)(F)(F)(F)F
InChIKey
ZHHGTMQHUWDEJF-UHFFFAOYSA-N
분자식
C11H15ClF6N5OP
평균 분자량
413.69 g/mol

이름 및 식별자

우선 이름
O-(6-Chlorobenzotriazol-1-yl)-N,N,N',N'-tetramethyluronium hexafluorophosphate
IUPAC
[(6-chlorobenzotriazol-1-yl)oxy-(dimethylamino)methylidene]-dimethylazanium hexafluorophosphate

이름 및 동의어

HCTUO-(6-Chlorobenzotriazol-1-yl)-N,N,N',N'-tetramethyluronium hexafluorophosphate2-(6-Chloro-1H-benzo[d][1,2,3]triazol-1-yl)-1,1,3,3-tetramethyluronium hexafluorophosphate(V)1415232-65-3MFCD04973268[(6-chlorobenzotriazol-1-yl)oxy-(dimethylamino)methylidene]-dimethylazanium;hexafluorophosphate2-(6-chloro-1H-benzo[d][1,2,3]triazol-1-yl)-1,1,3,3-tetramethylisouronium hexafluorophosphate(V)1-(Bis-dimethylamino-methylene)-5-chloro-3-oxy-1H-benzotriazol-1-ium hexafluorophosphate1-[Bis(dimethylamino)methylen]-5-chlorobenzotriazolium 3-oxide hexafluorophosphateC11H15ClF6N5OPHCTU ReagentSCHEMBL19894763
이름 더 보기
SCHEMBL29350952KHC-1018-PIAKOS015965072AKOS015965073AKOS016003452AC-4419CS-W011667FH15560

데이터베이스 식별자

PubChem CID
42624899

물성

구조 계산 물성

극성 표면적
46.2 Ų
수소 결합 공여자 수
0
수소 결합 수용자 수
10
회전 가능 결합 수
3
무거운 원자 수
25

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