基本情報
- CAS
2338-05-8- 標準SMILES
O=C([O-])CC(O)(CC(=O)[O-])C(=O)[O-].[Fe+3]- InChIKey
NPFOYSMITVOQOS-UHFFFAOYSA-K- 分子式
- C6H5FeO7
- 平均分子量
- 244.94 g/mol
- 単同位体質量
- 244.938463
概要
RN given refers to Fe(+3)[1:1] salt
名称と識別子
- 優先名称
- Ferric citrate
- IUPAC
- 2-hydroxypropane-1,2,3-tricarboxylate;iron(3+)
- 現地名
- 2-ヒドロキシ-1,2,3-プロパントリカルボン酸/鉄(III),(1:x)
- 英語名
- citric acid, iron(3+) salt
- 分子式
- C6H8FeO7
- 分子量
- 247.97
名称と別名
FERRIC CITRATEIron(III) citrate3522-50-7Zerenexferrum citricum28633-45-6FexericIron citrate, FeC6H5O7Iron(III) citrate tribasicCitric acid, iron saltferric citrate anhydrousJTT 751
名称をさらに表示
2-ヒドロキシ-1,2,3-プロパントリカルボン酸/鉄(III),(1:x)citric acid, iron(3+) salt2-hydroxy-1,2,3-propanetricarboxylic acid iron salt1,2,3-Propanetricarboxylic acid, 2-hydroxy-, iron(3+) salt2-Hydroxy-1,2,3-propanetricarboxylic acid/iron(III),(1:x) salt
Iron, (hydrogen citrato(3-))-Iron(III)-citrateIron (III) citrateUNII-63G354M39ZJTT-751KRX-0502EINECS 222-536-6EINECS 249-117-0
データベース識別子
- CAS
2338-05-8、28633-45-6、3522-50-7- PubChem CID
- 61300
- DTXSID
DTXSID0037657- ChEMBL
CHEMBL3301597- UNII
- 63G354M39Z
物性
構造計算による物性
- 極性表面積
- 141 Ų
- 水素結合供与体数
- 1
- 水素結合受容体数
- 7
- 回転可能結合数
- 2
- 重原子数
- 14
- 形式電荷
- 0
- 複雑度
- 211
実験および物理化学的性質
Cosmetics
Cosmetic ingredients (Ferric Citrate) -> CIR (Cosmetic Ingredient Review)
Skin conditioning
Food Additives
NUTRIENT SUPPLEMENT -> FDA Substance added to food
NUTRIENT SUPPLEMENT -> FDA Substance added to food
Human Drugs
Breast Feeding; Lactation; Milk, Human; Ferric Compounds; Hematinics; Iron Compounds; Minerals
FDA approved drugs -> Active ingredient
FDA approved drugs -> Active ingredient
物理化学的性質
- 水溶解度
- 2 O;不溶性アルコール · 可溶性H2O;不溶性アルコール [HAW93]
- LogP
- -1.721 · -1.721 (est)
化学的性質
化学的特性reddish brown scales; light sensitive; used in medicine and in blueprinting paper [HAW93]
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
This chemical does not meet GHS hazard criteria for 1.9% (2 of 107) of reports.
Warning
H319 (98.1%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]
P264+P265, P280, P305+P351+P338, and P337+P317 (click each P-code to see the statement)
Aggregated GHS information provided per 107 reports by companies from 2 notifications to the ECHA C&L Inventory.
Warning
危険有害性情報
Regulatory Information
Chemical: 1,2,3-Propanetricarboxylic acid, 2-hydroxy-, iron(3+) salt (1:1)
Chemical: 1,2,3-Propanetricarboxylic acid, 2-hydroxy-, iron salt
Chemical: 1,2,3-Propanetricarboxylic acid, 2-hydroxy-, iron(3+) salt
Regulation (EC) No 1831/2003 (amended)
REACH registered substance: Iron citrate (EC: 219-045-4)
Ferric citrate: Does not have an individual approval but may be used as a component in a product covered by a group standard. It is not approved for use as a chemical in its own right.
Other Safety Information
IMAP assessments - 1,2,3-Propanetricarboxylic acid, 2-hydroxy-, iron salt: Human health tier I assessment
IMAP assessments - 1,2,3-Propanetricarboxylic acid, 2-hydroxy-, iron(3+) salt (1:1): Human health tier I assessment
IMAP assessments - 1,2,3-Propanetricarboxylic acid, 2-hydroxy-, iron(3+) salt: Human health tier I assessment
Hazard Classes and Categories
Eye Irrit. 2 (100%)
Eye Irrit. 2 (88.5%)
Eye Irrit. 2 (98.1%)
毒性情報
Toxicity SummarySafe in the present practices of use and concentration. Ingredient, concentration, and use information are available in documents discoverable at https://cir-reports.cir-safety.org
化学と産業
薬理情報
ATC Code
V - Various
QV - Various
FDA Pharmacological Classification
FERRIC CITRATE
Phosphate Chelating Activity [MoA]; Parenteral Iron Replacement [EPC]; Iron [CS]; Phosphate Binder [EPC]
用途と製造
UsesCIR ingredient: Ferric Citrate
Household ProductsInformation on 1 consumer products that contain Ferric Citrate in the following categories is provided:
Use ClassificationCosmetics -> Skin conditioning
General Manufacturing Information1,2,3-Propanetricarboxylic acid, 2-hydroxy-, iron salt (1:?): ACTIVE
上流・下流製品情報
上流原料
サプライヤー8 社
湖北威德利化学试剂有限公司186-02735115 18062128043 · [email protected]
陕西缔都新材料有限公司029-63373950 17392216152 · [email protected]
湖北威德利化学试剂有限公司17771473825 13385289472 · [email protected]
Alfa Chemistry1-516-6625404 · [email protected]
関連反応
1 件
化合物ノート
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