HCID67907

Pentafluoropropionaldehyde

2,2,3,3,3-pentafluoropropanal

C3HF5O148.03 g/molCAS 422-06-0

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IDENTITY

结构与身份

标准 SMILES: O=CC(F)(F)C(F)(F)F
InChIKey: IRPGOXJVTQTAAN-UHFFFAOYSA-N
分子式: C3HF5O
平均分子量: 148.03 g/mol
单同位素质量: 147.99475546

COMPUTED

结构计算性质

已同步

XLogP: 1.5
极性表面积: 17.1 Å²
氢键供体: 0
氢键受体: 6
可旋转键: 1
重原子: 9
形式电荷: 0
复杂度: 114

ALIASES

名称与别名

共 19 条

2,2,3,3,3-PentafluoropropanalPentafluoropropionaldehyde422-06-0Propanal, pentafluoro-PerfluoropropionaldehydePropionaldehyde, pentafluoro-UP47XVV2P8pentafluoropropanalEINECS 207-013-2propanal, 2,2,3,3,3-pentafluoro-Pentafluoropropionaldehyde hydrate, tech.UNII-UP47XVV2P8SCHEMBL137007SCHEMBL808892DTXSID601950272,2,3,3,3-Pentafluoropropanal #AKOS009158211NS00043341EN300-364982

REACTIONS

参与反应

4 条

全部作为反应物作为生成物作为试剂作为催化剂作为溶剂

HRID209831

Training data from https://doi.org/10.1039/C8SC04228D (6/10)

作为反应物

Training data from https://doi.org/10.1039/C8SC04228D (6/10) · 10.1039/C8SC04228D

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HRID479540

uspto-grants-2003_11

作为反应物

uspto-grants-2003_11 · 10.6084/m9.figshare.5104873.v1 · US06645968B2

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HRID479541

uspto-grants-2003_11

作为反应物

uspto-grants-2003_11 · 10.6084/m9.figshare.5104873.v1 · US06645968B2

查看条件与参与物

HRID1235694

Training data from https://doi.org/10.1039/C8SC04228D (5/10)

作为反应物

Training data from https://doi.org/10.1039/C8SC04228D (5/10) · 10.1039/C8SC04228D

查看条件与参与物