基本情報
- CAS
66034-17-1- 標準SMILES
C1CNCCN1.O=P(O)(O)OP(=O)(O)O- InChIKey
MWFNQNPDUTULBC-UHFFFAOYSA-N- 分子式
- C4H10N2.H4O7P2
- 平均分子量
- 264.11 g/mol
- 単同位体質量
- 264.02762405
名称と識別子
- 優先名称
- Diphosphoric acid, compd. with piperazine (1:1)
- IUPAC
- phosphono dihydrogen phosphate;piperazine
- 英語名
- Diphosphoric acid compd. with-piperazine (1:1)
- 分子式
- C4H14N2O7P2
- 分子量
- 264.11
名称と別名
66034-17-1PTA3A6GZRHUNII-PTA3A6GZRHDTXSID10886791RefChem:134726DTXCID201026110457-330-7613-872-8piperazine pyrophosphateDiphosphoric Acid Piperazinephosphono dihydrogen phosphate;piperazineSCHEMBL225177
名称をさらに表示
pyrophosphate piperazinePiperazine diphosphate (PAPP)PyrophosphoricacidpiperazinesaltDIPHOSPHORIC ACID COMPD. WITH-PIPERAZINEphosphono dihydrogen phosphate,piperazineDiphosphoric acid compd. with-piperazine (1:1)
Diphosphoric acid--piperazine (1/1)SY439258DB-141706NS00078597Diphosphoric acid,compd. with piperazine (1:1)Q27286739
データベース識別子
- CAS
66034-17-1- PubChem CID
- 21989140
- DTXSID
DTXSID10886791- UNII
- PTA3A6GZRH
- EC Number
- 457-330-7、613-872-8
物性
構造計算による物性
- 極性表面積
- 148 Ų
- 水素結合供与体数
- 6
- 水素結合受容体数
- 9
- 回転可能結合数
- 2
- 重原子数
- 15
- 形式電荷
- 0
- 複雑度
- 174
実験および物理化学的性質
Physical DescriptionDry Powder; CBI
物理化学的性質
- 比重(密度)
- 1.71 g/cm3 · 1.71 g/cm3
- 蒸気圧
- 0 Pa · 0Pa at 49℃
- 水溶解度
- 12.24 g/L · 12.24g/L at 20℃
- InChI
- InChI=1S/C4H10N2.H4O7P2/c1-2-6-4-3-5-1;1-8(2,3)7-9(4,5)6/h5-6H,1-4H2;(H2,1,2,3)(H2,4,5,6)
- InChIKey
- MWFNQNPDUTULBC-UHFFFAOYSA-N
- SMILES
- C1NCCNC1.O(P(O)(O)=O)P(O)(O)=O
- LogP
- -1 at · -1 at 20℃
- EPAの化学物質情報
- Diphosphoric acid, compd. with piperazine (1:1) (66034-17-1)
安全と法規制
GHS分類
GHS Classification
Warning
H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]
P264+P265, P273, P280, P305+P351+P338, P337+P317, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 447 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Warning
H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]
危険有害性情報
Regulatory Information
Chemical: Diphosphoric acid, compd. with piperazine (1:1)
Diphosphoric acid, compd. with piperazine (1:1) is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of Diphosphoric acid, compd. with piperazine (1:1) are required to report information about their production and use of this chemical to the EPA under the Toxic Substances Control Act (TSCA). (40 eCFR Part 711)
PMN - indicates a commenced PMN (Pre-Manufacture Notices) substance.
Status: Active Update: 13-07-2022 https://echa.europa.eu/registration-dossier/-/registered-dossier/10424
Hazard Classes and Categories
Eye Irrit. 2 (100%)
Eye Irrit. 2 (100%)
Eye irritation - category 2A
安全データ
- tsca
- TSCA listed
化学と産業
用途と製造
U.S. Production2023: 250,000 - <550,000 lb
Industry UsesFlame retardant
General Manufacturing Information
Plastics Material and Resin Manufacturing
Diphosphoric acid, compd. with piperazine (1:1): ACTIVE
上流・下流製品情報
上流原料
サプライヤー67 社
Hebei Chuanghai Biotechnology Co., Ltd+86-17732866630 · [email protected]
广州纳珑化工有限公司13192879270; 13192879270 · [email protected]
陕西缔都新材料有限公司029-63373950 17392216152 · [email protected]
苏州市森菲达化工有限公司18796480002 18796480002 · [email protected]
河北创海生物科技有限公司+86-86-13131129325 · [email protected]
武汉吉业升化工有限公司027-83360216 18040558719 · [email protected]
Guangzhou Xijia New Materials Co.,Ltd
関連反応
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化合物ノート
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