基本情報
- CAS
17647-60-8- 標準SMILES
Oc1cc2c(cc1O)C1c3ccc(O)c(O)c3OCC1(O)C2- InChIKey
WZUVPPKBWHMQCE-UHFFFAOYSA-N- 分子式
- C16H14O6
- 平均分子量
- 302.28 g/mol
- 単同位体質量
- 302.07903816
概要
Haematoxylin is an organic heterotetracyclic compound 7,11b-dihydroindeno[2,1-c]chromene carrying five hydroxy substituents at positions 3, 4, 6a, 9 and 10. The most important and most used dye in histology, histochemistry, histopathology and in cytology. It has a role as a plant metabolite and a histological dye. It is a polyphenol, a tertiary alcohol, an oxacycle and an organic heterotetracyclic compound.
名称と識別子
- 優先名称
- 7,11b-dihydrobenz(b)indeno(1,2-d)pyran-3,4,6a,9,10(6H)-pentol
- IUPAC
- 7,11b-dihydro-6H-indeno[2,1-c]chromene-3,4,6a,9,10-pentol
- 英語名
- Benz[b]indeno[1,2-d]pyran-3,4,6a,9,10(6H)-pentol,7,11b-dihydro-
- 分子式
- C16H14O6
- 分子量
- 302.27876
名称と別名
7,11b-dihydrobenz[b]indeno[1,2-d]pyran-3,4,6a,9,10(6H)-pentolBenz(b)indeno(1,2-d)pyran-3,4,6a,9,10(6H)-pentol, 7,11b-dihydro-, (6aS,11bR)-Benz[b]indeno[1,2-d]pyran-3,4,6a,9,10(6H)-pentol, 7,11b-dihydro-, (6aS,11bR)-7,11b-dihydrobenz(b)indeno(1,2-d)pyran-3,4,6a,9,10(6H)-pentolRefChem:54469817647-60-8NSC86627,11b-Dihydroindeno[2,1-c]chromene-3,4,6a,9,10(6H)-pentolHematoxylin, TrihydrateNatural Black IMLS0008767436,6a,7,11b-tetrahydroindeno[2,1-c]chromene-3,4,6a,9,10-pentaol
名称をさらに表示
7,11b-dihydro-6H-indeno[2,1-c]chromene-3,4,6a,9,10-pentolBenz[b]indeno[1,2-d]pyran-3,4,6a,9,10(6H)-pentol,7,11b-dihydro-
SMR000440556hematoxilinaNCI-C558897,11b-Dihydroindeno(2,1-c)chromene-3,4,6a,9,10(6H)-pentol1412-19-7cid_10603MFCD00078111CI 75290
データベース識別子
- CAS
17647-60-8、517-28-2- PubChem CID
- 10603
- DTXSID
DTXSID00859439- ChEMBL
CHEMBL1479103- ChEBI
CHEBI:51686- EC Number
- 110-400-8
- Nikkaji
- J3.539.689F
物性
構造計算による物性
- XLogP
- 1.2
- 極性表面積
- 110 Ų
- 水素結合供与体数
- 5
- 水素結合受容体数
- 6
- 回転可能結合数
- 0
- 重原子数
- 22
- 形式電荷
- 0
- 複雑度
- 444
安全と法規制
安全情報は参考情報です。供給元の安全データシート（SDS）、適用法令、専門家による評価に代わるものではありません。
GHS分類
GHS Classification
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)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
危険有害性情報
Regulatory InformationHematoxylin: Does not have an individual approval but may be used under an appropriate group standard
Hazard Classes and CategoriesSkin Irrit. 2 (100%)
化学と産業
用途と製造
General Manufacturing InformationBenz[b]indeno[1,2-d]pyran-3,4,6a,9,10(6H)-pentol, 7,11b-dihydro-, (6aS,11bR)-: ACTIVE
サプライヤー1 社
西格玛奥德里奇（上海）贸易有限公司21-20338288 · [email protected]
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