基本情報
- CAS
29702-43-0- 標準SMILES
O=C[C@H](F)[C@@H](O)[C@H](O)[C@H](O)CO- InChIKey
AOYNUTHNTBLRMT-SLPGGIOYSA-N- 分子式
- C6H11FO5
- 平均分子量
- 182.15 g/mol
- 単同位体質量
- 182.05905161
概要
2-deoxy-2-fluoro-aldehydo-D-glucose is an aldehyde and a 2-deoxy-2-fluoro-D-glucose. It is functionally related to an aldehydo-D-glucose.
名称と識別子
- 優先名称
- 2-Fluoro-2-deoxy-D-glucose
- IUPAC
- (2R,3S,4R,5R)-2-fluoro-3,4,5,6-tetrahydroxyhexanal
- 英語名
- 2-DEOXY-2-FLUORO-D-GLUCOSE
- 分子式
- C6H11FO5
- 分子量
- 182.15
名称と別名
29702-43-02-Fluoro-2-deoxy-D-glucoseFludeoxyglucoseZO2JV75L55alpha-D-Glucopyranose, 2-deoxy-2-fluoroDTXSID7013115922-Fluoro-2-deoxyglucose2 Fluoro 2 deoxyglucoseRefChem:472180GlyTouCan:G62090LW2 Fluoro 2 deoxy D glucoseDTXCID001741421
名称をさらに表示
FDG2-DEOXY-FLUORO-GLUCOSE2-DEOXY-2-FLUOROGLUCOSED-GLUCOPYRANOSE, 2-DEOXY-2-FLUORO-2-Deoxy-2-fluoro-D-glucose86783-82-62-fluoro-2-deoxy-D-glucose, mixture of anomers2-Deoxy-2-fluoro-D-glucose, 2-Deoxy-fluoro-glucose
G62090LW635-951-6636-698-42-Deoxy-2-fluoro-D-glucose(2R,3S,4R,5R)-2-fluoro-3,4,5,6-tetrahydroxyhexanalMFCD00077527C6H11FO5d-glucose, 2-deoxy-2-fluoro-
データベース識別子
- CAS
29702-43-0、38440-79-8、86783-82-6- PubChem CID
- 170049
- DTXSID
DTXSID701311592- ChEMBL
CHEMBL1908940、CHEMBL2068864- ChEBI
CHEBI:49135- UNII
- ZO2JV75L55
- EC Number
- 635-951-6、636-698-4
- Nikkaji
- J88.623H
物性
構造計算による物性
- XLogP
- -2.4
- 極性表面積
- 98 Ų
- 水素結合供与体数
- 4
- 水素結合受容体数
- 6
- 回転可能結合数
- 5
- 重原子数
- 12
- 形式電荷
- 0
- 複雑度
- 142
実験および物理化学的性質
DrugsPharmaceuticals -> Listed in ZINC15
物理化学的性質
- 貯蔵温度
- 2 · 2-8°C
化学的性質
化学的特性Colourless solid
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)
Aggregated GHS information provided per 41 reports by companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Warning
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
危険有害性情報
Hazard Classes and Categories
Skin Irrit. 2 (100%)
Skin Irrit. 2 (100%)
安全データ
- wgk
- 3
- risk_code
- 36/37/38
- hazard_code
- Xi
- safety_code
- 26-36
化学と産業
薬理情報
MeSH Pharmacological ClassificationCompounds that are used in medicine as sources of radiation for radiotherapy and for diagnostic purposes. They have numerous uses in research and industry. (Martindale, The Extra Pharmacopoeia, 30th ed, p1161)
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