Naphthazarin

HCID 10141CAS 475-38-7
부분 구조 검색유사 구조 찾기

기본 정보

표준 SMILES
O=C1C=CC(=O)c2c(O)ccc(O)c21
InChIKey
RQNVIKXOOKXAJQ-UHFFFAOYSA-N
분자식
C10H6O4
평균 분자량
190.15 g/mol
단동위원소 질량
190.02660867

개요

Naphthazarin is a naphthoquinone that is 1,4-naphthoquinone in which the hydrogens at positions 5 and 8 are replaced by hydroxy groups. It has a role as a geroprotector, an acaricide, an antibacterial agent, an antineoplastic agent, an apoptosis inducer and a plant metabolite.

이름 및 식별자

우선 이름
Naphthazarin
IUPAC
5,8-dihydroxynaphthalene-1,4-dione
영어명
5,8-Dihydroxy-1,4-naphthoquinone
분자식
C10H6O4
분자량
190.15

이름 및 동의어

Naphthazarin5,8-Dihydroxy-1,4-naphthoquinone475-38-75,8-dihydroxynaphthalene-1,4-dioneNaphthazarineNaphthazarone5,8-Dihydroxynaphthoquinone5,8-Dihydroxy-1,4-naphthalenedione5,8-Dihydroxy-1,4-naphthosemiquinone1,4-NAPHTHOQUINONE, 5,8-DIHYDROXY-1,4-Naphthalenedione, 5,8-dihydroxy-S9IX5I5C0K
이름 더 보기
NAPHTHAZALINEMordant Black 37Naphthazarin (6CI)5,8-Dihydroxy-1,4-nNaphthazarin, 10 mM in DMSO
5,8-dioxy-1,4-naphthoquinoneDTXSID00197161CHEBI:28849NSC-26647NSC-344555RefChem:831987DTXCID10119652207-495-4

데이터베이스 식별자

CAS
475-38-7
PubChem CID
10141
DTXSID
DTXSID00197161
ChEMBL
CHEMBL274056
ChEBI
CHEBI:28849
UNII
S9IX5I5C0K
EC Number
207-495-4
Nikkaji
J12.362E、J939.863E

물성

구조 계산 물성

XLogP
1.8
극성 표면적
74.6 Ų
수소 결합 공여자 수
2
수소 결합 수용자 수
4
회전 가능 결합 수
0
무거운 원자 수
14

실험 및 물리화학적 성질

Chemical ClassesOther Uses -> Biochemical Research
SpringerMaterials PropertiesChemical shift
LogP1.79
Vapor Pressure0.0000001 [mmHg]
Physical DescriptionBrown solid; [Alfa Aesar MSDS]

물리화학적 성질

녹는점
220 · 220-230 °C(lit.)
끓는 점
285.64 °C · 285.64°C (rough estimate)
밀도
1.3366 · 1.3366 (rough estimate)
굴절률
1.528 · 1.5280 (estimate)
저장 조건
Sealed in dry,Room Temperature
물리적 상태
powder to crystaline

화학적 성질

dark purple to brown-black powder

안전 및 규제

GHS 분류

GHS Classification · 4건

Warning

H302 (33.3%): Harmful if swallowed [Warning Acute toxicity, oral]

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 6 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

유해성 정보

Hazards SummaryA skin and strong eye irritant; [Alfa Aesar MSDS]
Hazard Classes and CategoriesAcute Tox. 4 (33.3%)

안전 데이터

wgk
3
rtecs
QL7970000
HS 번호
2914409000
risk_code
36/37/38
hazard_code
Xi
safety_code
22-24/25-37/39-26

화학 및 산업

약리 정보

MeSH Pharmacological ClassificationSubstances that inhibit or prevent the proliferation of NEOPLASMS.

용도 및 제조

UsesA fish toxin; [ChemIDplus]

제조 방법

1,8-Dinitronaphthalene and 1,5-Dinitronaphthalene mixture or both alone and one of sulfur 40% fuming sulfuric ACID reaction, the product (5, 8 – dihydroxy – naphthoquinone) into Sulfurous acidhydrogen salt.

상·하류 제품 정보

공급사50 곳

梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
南京世洲生物科技有限公司025-85560043 15850508050 · [email protected]
阿诺西（上海）生物技术有限公司400-1107768 15058188853 · [email protected]
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
Hebei Chuanghai Biotechnology Co., Ltd+86-17732866630 · [email protected]

추가 설명

정의ChEBI: A naphthoquinone that is 1,4-naphthoquinone in which the hydrogens at positions 5 and 8 are replaced by hydroxy groups.

관련 반응

2건
반응 기록 만들기

연결된 노트

불러오는 중…