3-(2-(4-(2-(4-(2-(6-Amino-1-hydroxy-3-sulfo-2-naphthalenyl)diazenyl)-6-sulfo-1-naphthalenyl)diazenyl)-1-naphthalenyl)diazenyl)-1,5-naphthalenedisulfonic acid

HCID 20428CAS 25255-02-1
부분 구조 검색유사 구조 찾기

기본 정보

표준 SMILES
Nc1ccc2c(O)c(N=Nc3ccc(N=Nc4ccc(N=Nc5cc(S(=O)(=O)O)c6cccc(S(=O)(=O)O)c6c5)c5ccccc45)c4ccc(S(=O)(=O)O)cc34)c(S(=O)(=O)O)cc2c1
InChIKey
UVPBSQSZCVRVOH-UHFFFAOYSA-N
분자식
C40H27N7O13S4
평균 분자량
941.9 g/mol
단동위원소 질량
941.05496792

이름 및 식별자

우선 이름
3-(2-(4-(2-(4-(2-(6-Amino-1-hydroxy-3-sulfo-2-naphthalenyl)diazenyl)-6-sulfo-1-naphthalenyl)diazenyl)-1-naphthalenyl)diazenyl)-1,5-naphthalenedisulfonic acid
IUPAC
3-[[4-[[4-[(6-amino-1-hydroxy-3-sulfonaphthalen-2-yl)diazenyl]-6-sulfonaphthalen-1-yl]diazenyl]naphthalen-1-yl]diazenyl]naphthalene-1,5-disulfonic acid
영어명
3-[[4-[[4-[(6-Amino-1-hydroxy-3-sulfo-2-naphtyl)azo]-6-sulfo-1-naphtyl]azo]-1-naphtyl]azo]-1,5-naphthalenedisulfonic acid
분자식
C40H27N7O13S4
분자량
941.94

이름 및 동의어

25255-02-13-(2-(4-(2-(4-(2-(6-Amino-1-hydroxy-3-sulfo-2-naphthalenyl)diazenyl)-6-sulfo-1-naphthalenyl)diazenyl)-1-naphthalenyl)diazenyl)-1,5-naphthalenedisulfonic acid3-[2-[4-[2-[4-[2-(6-Amino-1-hydroxy-3-sulfo-2-naphthalenyl)diazenyl]-6-sulfo-1-naphthalenyl]diazenyl]-1-naphthalenyl]diazenyl]-1,5-naphthalenedisulfonic acidRefChem:198170Direct Blue 71 parentZ22F9E7M751,5-Naphthalenedisulfonic acid, 3-((4-((4-((6-amino-1-hydroxy-3-sulfo-2-naphthalenyl)azo)-6-sulfo-1-naphthalenyl)azo)-1-naphthalenyl)azo)-1,5-Naphthalenedisulfonic acid, 3-(2-(4-(2-(4-(2-(6-amino-1-hydroxy-3-sulfo-2-naphthalenyl)diazenyl)-6-sulfo-1-naphthalenyl)diazenyl)-1-naphthalenyl)diazenyl)-3-((4-((4-((7-Amino-4-hydroxy-2-sulfo-3-naphthalenyl)azo)-6-sulfo-1-naphthalenyl)azo)-1-naphthalenyl)azo)-1,5-naphthalenedisulfonic acidJ301.908JUNII-Z22F9E7M75DTXSID7045071
이름 더 보기
3-[[4-[[4-[(6-Amino-1-hydroxy-3-sulfo-2-naphtyl)azo]-6-sulfo-1-naphtyl]azo]-1-naphtyl]azo]-1,5-naphthalenedisulfonic acid1,5-Naphthalenedisulfonic acid, 3-[2-[4-[2-[4-[2-(6-amino-1-hydroxy-3-sulfo-2-naphthalenyl)diazenyl]-6-sulfo-1-naphthalenyl]diazenyl]-1-naphthalenyl]diazenyl]-
SCHEMBL13673457C. I. 34140Q272948933-((4-((4-((6-AMINO-1-HYDROXY-3-SULFO-2-NAPHTHYL)AZO)-6-SULFO-1-NAPHTHYL)AZO)-1-NAPHTHYL)AZO)-1,5-NAPHTHALENEDISULFONIC ACID3-((4-((4-((6-AMINO-1-HYDROXY-3-SULFO-2-NAPHTHYL)DIAZENYL)-6-SULFO-1-NAPHTHYL)DIAZENYL)-1-NAPHTHYL)DIAZENYL)-1,5-NAPHTHALENEDISULFONIC ACID3-((4-((4-((6-AMINO-1-HYDROXY-3-SULFO-2-NAPHTHYL)DIAZENYL)-6-SULFO-1-NAPHTHYL)DIAZENYL)-1-NAPHTHYL)DIAZENYL)NAPHTHALENE-1,5-DISULFONIC ACID3-[[4-[[4-[(6-amino-1-hydroxy-3-sulfo-2-naphthyl)azo]-6-sulfo-1-naphthyl]azo]-1-naphthyl]azo]naphthalene-1,5-disulfonic acid3-{[4-({4-[(6-Amino-1-hydroxy-3-sulfonaphthalen-2-yl)diazenyl]-6-sulfonaphthalen-1-yl}diazenyl)naphthalen-1-yl]diazenyl}naphthalene-1,5-disulfonic acid

데이터베이스 식별자

CAS
25255-02-1、4399-55-7
PubChem CID
20428
DTXSID
DTXSID7045071
UNII
Z22F9E7M75
Nikkaji
J301.908J

물성

구조 계산 물성

XLogP
6.2
극성 표면적
371 Ų
수소 결합 공여자 수
6
수소 결합 수용자 수
20
회전 가능 결합 수
10
무거운 원자 수
64

물리화학적 성질

EPA
1 · 1,5-Naphthalenedisulfonic acid, 3-[[4-[[4-[(6-amino-1-hydroxy-3-sulfo-2-naphthalenyl)azo]-6-sulfo-1-naphthalenyl]azo]-1-naphthalenyl]azo]- (25255-02-1)

안전 및 규제

안전 데이터

tsca
TSCA listed

화학 및 산업

용도 및 제조

General Manufacturing Information1,5-Naphthalenedisulfonic acid, 3-[2-[4-[2-[4-[2-(6-amino-1-hydroxy-3-sulfo-2-naphthalenyl)diazenyl]-6-sulfo-1-naphthalenyl]diazenyl]-1-naphthalenyl]diazenyl]-: INACTIVE

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