2S-氨基-1-(磷酸二氢)-4E-十八烯-1,3R-二醇

Dihydrogenphosphate

HCID 1003CAS 14066-20-7

子结构检索查找相似结构

基本信息

标准SMILES: O=P([O-])(O)O
InChIKey: NBIIXXVUZAFLBC-UHFFFAOYSA-M
分子式: H2O4P-
平均分子量: 96.987 g/mol
单同位素质量: 96.96907054

名称与标识

首选名称: Dihydrogenphosphate
IUPAC: dihydrogen phosphate
中文名: 2S-氨基-1-(磷酸二氢)-4E-十八烯-1,3R-二醇
英文名: Phosphate, dihydrogen
分子式: H2O4P
分子量: 0

名称与别名

dihydrogenphosphateDIHYDROGENPHOSPHATE IONdihydrogentetraoxophosphate(V)dihydrogentetraoxophosphate(1-)dihydroxidodioxidophosphate(1-)CHEBI:39745dihydrogen(tetraoxidophosphate)(1-)H2PO4(-)(PO2(OH)2)(-)[PO2(OH)2](-)RefChem:6532DIHYDROGEN PHOSPHATE

展开更多名称

DihydroxyphosphinatePhosphoric acid dihydrogen anion

Phosphate, dihydrogen14066-20-7H2PO4-DTXSID40930897BDBM50004328BDBM50155534DB02831NS00129655

数据库标识

CAS: 14066-20-7、29505-79-1
PubChem CID: 1003
DTXSID: DTXSID40930897
ChEBI: CHEBI:39745
Nikkaji: J2.449.279F、J238.533C、J3.155.004A、J997.145I

性质

结构计算性质

XLogP: -2.2
极性表面积: 80.6 Å²
氢键供体: 2
氢键受体: 4
可旋转键: 0
重原子: 5
形式电荷: -1
复杂度: 49

物理化学性质

熔点: 213.6 · 213.6-214.3 °C

安全与法规

危害信息

Regulatory InformationPhosphate, dihydrogen: 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.