Diphosphate | 14000-31-8
Diphosphate
14000-31-8
O7P2-4
173.9434
名称和标识符
InChIKey |
XPPKVPWEQAFLFU-UHFFFAOYSA-J |
Inchi |
InChI=1S/H4O7P2/c1-8(2,3)7-9(4,5)6/h(H2,1,2,3)(H2,4,5,6)/p-4 |
SMILES |
O=P(OP([O-])(=O)[O-])([O-])[O-] |
别名信息
- 英文别名 -
- Diphosphate
- phosphonato phosphate
- dihydrogen pyrophosphate
- Diphosphat
- diphosphoric acid
- polyphosphoric acid
- Pyrometaphosphate
- Pyrophosphat
- pyrophosphate
- Pyrophosphate ion
- Pyrophosphate tetraanion
- Pyrophosphic acid
- diphosphate(4-)
- diphospate
- 3c14
- 2o1c
- Diphosphate (P2O74-)
- BDBM50278316
- (phosphonatooxy)phosphonate
- Pyrophosphate(4-) ion
- CHEBI:18361
- diphosphate
- Q290828
- UNII-X3SSV2V6L3
- 14000-31-8
- [O3POPO3](4-)
- Diphosphate(4-)
- mu-oxido-bis(trioxidophosphate)(4-)
- DTXSID4074514
- DF048DC2-F386-4F01-8876-FD4CD8DE4A9F
- XPPKVPWEQAFLFU-UHFFFAOYSA-J
- Diphosphates
- X3SSV2V6L3
- Phosphate (P2O74-)
- diphosphoric acid, ion(4-)
- pyrophosphate anion
- Pyrophosphate (P2O74-)
- P2O7(4-)
- mu-oxo-hexaoxodiphosphate
- Pyrophosphate(4-)
物化性质
实验特性
LogP |
0.94120 |
PSA |
155.23000 |
计算特性
精确分子量 |
173.91200 |
氢键供体数量 |
0 |
氢键受体数量 |
7 |
可旋转化学键数量 |
0 |
同位素质量 |
173.91192633g/mol |
重原子数量 |
9 |
复杂度 |
124 |
同位素原子数量 |
0 |
确定原子立构中心数量 |
0 |
不确定原子立构中心数量 |
0 |
确定化学键立构中心数量 |
0 |
不确定化学键立构中心数量 |
0 |
共价键单元数量 |
1 |
疏水参数计算参考值(XlogP) |
-3.5 |
拓扑分子极性表面积 |
136Ų |
相关文献
-
1.
Five- and six-fold coordinated silicon in silicodiphosphonates: short range order investigation by solid-state NMR spectroscopy
Christine Viehweger,Janine Kowalke,Erica Brendler,Sandra Schwarzer,Claudia Vogt,Edwin Kroke New J. Chem. 2020 44 4613
-
2.
Terpenoid synthase structures: a so far incomplete view of complex catalysis
Yang Gao,Richard B. Honzatko,Reuben J. Peters Nat. Prod. Rep. 2012 29 1153
-
3.
Synthesis of phosphonoacetate analogues of the second messenger adenosine 5′-diphosphate ribose (ADPR)
Ond?ej Baszczyňski,Joanna M. Watt,Monika D. Rozewitz,Ralf Fliegert,Andreas H. Guse,Barry V. L. Potter RSC Adv. 2020 10 1776
-
4.
Two new cantilever-type polyoxometalates constructed from {Mo2O4}2+ fragments and diphosphonates
Huaqiao Tan,Weilin Chen,Ding Liu,Yangguang Li,Enbo Wang Dalton Trans. 2010 39 1245
-
5.
Ultrafine molybdenum phosphide nanocrystals on a highly porous N,P-codoped carbon matrix as an efficient catalyst for the hydrogen evolution reaction
Jin-Tao Ren,Lei Chen,Chen-Chen Weng,Zhong-Yong Yuan Mater. Chem. Front. 2018 2 1987
-
6.
Ultrafine molybdenum phosphide nanocrystals on a highly porous N,P-codoped carbon matrix as an efficient catalyst for the hydrogen evolution reaction
Jin-Tao Ren,Lei Chen,Chen-Chen Weng,Zhong-Yong Yuan Mater. Chem. Front. 2018 2 1987
-
7.
Electrostatic effects on (di)terpene synthase product outcome
Ke Zhou,Reuben J. Peters Chem. Commun. 2011 47 4074
-
8.
Quantum chemical dissection of the classic terpinyl/pinyl/bornyl/camphyl cation conundrum—the role of pyrophosphate in manipulating pathways to monoterpenes
Young J. Hong,Dean J. Tantillo Org. Biomol. Chem. 2010 8 4589
-
9.
Quantum chemical dissection of the classic terpinyl/pinyl/bornyl/camphyl cation conundrum—the role of pyrophosphate in manipulating pathways to monoterpenes
Young J. Hong,Dean J. Tantillo Org. Biomol. Chem. 2010 8 4589
-
10.
Quantum chemical dissection of the classic terpinyl/pinyl/bornyl/camphyl cation conundrum—the role of pyrophosphate in manipulating pathways to monoterpenes
Young J. Hong,Dean J. Tantillo Org. Biomol. Chem. 2010 8 4589
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