基本情報
- CAS
2617-47-2- 標準SMILES
O=P(O)(O)CO- InChIKey
GTTBQSNGUYHPNK-UHFFFAOYSA-N- 分子式
- CH5O4P
- 平均分子量
- 112.02 g/mol
- 単同位体質量
- 111.99254563
概要
Hydroxymethylphosphonic acid is a phosphonic acid having a hydroxymethyl group attached to the phosphorus. It has a role as an EC 3.11.1.3 (phosphonopyruvate hydrolase) inhibitor. It is a member of phosphonic acids and a one-carbon compound. It is functionally related to a phosphonic acid. It is a conjugate acid of a hydroxymethylphosphonate(1-).
名称と識別子
- 優先名称
- (Hydroxymethyl)phosphonic acid
- IUPAC
- hydroxymethylphosphonic acid
- 現地名
- ヒドロキシメチルホスホン酸
- 英語名
- PhosphonoMethanol
- 分子式
- CH5O4P
- 分子量
- 112.02
名称と別名
(Hydroxymethyl)phosphonic acid2617-47-2Hydroxymethylphosphonic acidPhosphonomethanolHydroxymethanephosphonic acidMethanehydroxyphosphonic acid(Hydroxymethyl)phosphonatePhosphonic acid, P-(hydroxymethyl)-Phosphonic acid, (hydroxymethyl)-P-(hydroxymethyl)phosphonic acidDO34G523HFEINECS 220-047-2
名称をさらに表示
ヒドロキシメチルホスホン酸methylolphosphonic acidHDROXYMETHYL PHOSPHONIC ACIDPhosphonic acid,P-(hydroxymethyl)-Hydroxymethylphosphonic acid, 98 %CA14233050 HydroxymethyLphosphoniCacidHydroxymethyl phosphonic acid in Acetonitrile
NSC 41905NSC 63035NSC-41905NSC-63035CHEBI:5810DTXSID5062554PHOSPHONIC ACID, P-(HYDROXYMETHYL)RefChem:406519
データベース識別子
- CAS
2617-47-2- PubChem CID
- 75795
物性
構造計算による物性
- XLogP
- -2.2
- 極性表面積
- 77.8 Ų
- 水素結合供与体数
- 3
- 水素結合受容体数
- 4
- 回転可能結合数
- 1
- 重原子数
- 6
- 形式電荷
- 0
- 複雑度
- 71.6
物理化学的性質
- 融点
- 95 · 95-97℃
- 沸点
- 79 · 79-81 °C(Press: 10 Torr)
- 比重(密度)
- 1.45 · 1.45
- 屈折率
- 1.497 · 1.4970
- 溶解性
- Methanol (Slightly), Water (Sparingly)
- 酸解離定数(Pka)
- 2.58 · 2.58±0.10(Predicted)
- 外見
- Solid
- 色
- White to Off-White
- 安定性
- Hygroscopic
- EPAの化学物質情報
- Phosphonic acid, (hydroxymethyl)- (2617-47-2)
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
Danger
H290 (100%): May be corrosive to metals [Warning Corrosive to Metals]
P234, P260, P264, P280, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P321, P363, P390, P405, P406, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 6 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
危険有害性情報
Regulatory Information
REACH registered substance: (hydroxymethyl)phosphonic acid (EC: 220-047-2)
Phosphonic acid, (hydroxymethyl)-: 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.
Hazard Classes and CategoriesMet. Corr. 1 (100%)
安全データ
- tsca
- TSCA listed
化学と産業
用途と製造
General Manufacturing InformationPhosphonic acid, P-(hydroxymethyl)-: ACTIVE
応用分野
使用Phosphonomethanol has been used in the investigation on the stereochemistry of 2-Hydroxyethylphosphonate Dioxygenase.
上流・下流製品情報
上流原料
下流製品
サプライヤー28 社
陕西凯尔凯医药科技有限公司029-2148545164 17392779578 · [email protected]
上海仲因实业有限公司2537653158 16621191650 · [email protected]
梯希爱（上海）化工贸易有限公司021-61109150 · [email protected]
上海柯维化学技术有限公司021-64609169 18901607656 · [email protected]
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