基本情報
- 標準SMILES
Cc1cccc(OCCOP(=O)([O-])[O-])c1.[K+].[K+]- InChIKey
BMDQYINOMFOOHD-UHFFFAOYSA-L- 分子式
- C9H11K2O5P
- 平均分子量
- 308.35 g/mol
名称と識別子
- 優先名称
- Poly(oxy-1,2-ethanediyl), alpha-phosphono-omega-(methylphenoxy)-, potassium salt (1:2)
- IUPAC
- dipotassium;2-(3-methylphenoxy)ethyl phosphate
- 英語名
- Poly(oxy-1,2-ethanediyl), .alpha.-phosphono-.omega.-(methylphenoxy)-, dipotassium salt
- 分子式
- C9H11K2O5P
- 分子量
- 308.351001
名称と別名
名称をさらに表示
データベース識別子
- CAS
66057-30-5- PubChem CID
- 171741
- EC Number
- 613-877-5
物性
構造計算による物性
- 極性表面積
- 81.7 Ų
- 水素結合供与体数
- 0
- 水素結合受容体数
- 5
- 回転可能結合数
- 4
- 重原子数
- 17
- 形式電荷
- 0
- 複雑度
- 215
物理化学的性質
- InChI
- InChI=1S/C9H13O5P.2K/c1-8-3-2-4-9(7-8)13-5-6-14-15(10,11)12;;/h2-4,7H,5-6H2,1H3,(H2,10,11,12);;/q;2*+1/p-2
- InChIKey
- BMDQYINOMFOOHD-UHFFFAOYSA-L
- SMILES
- [K+].[K+].P(=O)([O-])([O-])OC([H])([H])C([H])([H])OC1=C([H])C([H])=C([H])C(C([H])([H])[H])=C1[H]
- EPAの化学物質情報
- Poly(oxy-1,2-ethanediyl), .alpha.-phosphono-.omega.-(methylphenoxy)-, dipotassium salt (66057-30-5)
安全と法規制
GHS分類
GHS Classification
Warning
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
P264, P264+P265, P273, P280, P302+P352, P305+P351+P338, P321, P332+P317, P337+P317, P362+P364, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 78 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
Chemical: Poly(oxy-1,2-ethanediyl), .alpha.-phosphono-.omega.-(methylphenoxy)-, dipotassium salt
FRI - indicates a polymeric substance containing no free-radical initiator in its Inventory name but is considered to cover the designated polymer made with any free-radical initiator regardless of the amount used.
Poly(oxy-1,2-ethanediyl), .alpha.-phosphono-.omega.-(methylphenoxy)-, dipotassium salt: 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.
安全データ
- tsca
- TSCA listed
化学と産業
用途と製造
サプライヤー11 社
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