P-(1,5-Dihydroxy-2-oxo-3-pyrrolidinyl)phosphonic acid
C4H8NO6P
107729-45-3 Copyright (C) 2024 ACS
  0  0  0     0  0            999 V3000
M  V30 BEGIN CTAB
M  V30 COUNTS  12 12 0 0 0
M  V30 BEGIN ATOM
M  V30 1 P 5.1556 2.7104 0.0 0 VAL=5
M  V30 2 O 6.6956 2.7104 0.0 0
M  V30 3 O 5.1556 1.1704 0.0 0
M  V30 4 O 5.1556 4.2504 0.0 0
M  V30 5 O 3.1864 0.0000 0.0 0
M  V30 6 O 0.0000 1.0353 0.0 0
M  V30 7 O 0.0000 4.3856 0.0 0
M  V30 8 C 3.6156 2.7104 0.0 0
M  V30 9 C 2.7104 1.4645 0.0 0
M  V30 10 C 2.7104 3.9564 0.0 0
M  V30 11 N 1.2459 1.9404 0.0 0
M  V30 12 C 1.2459 3.4804 0.0 0
M  V30 END ATOM
M  V30 BEGIN BOND
M  V30 1 2 1 2
M  V30 2 1 1 3
M  V30 3 1 1 4
M  V30 4 1 1 8
M  V30 5 2 5 9
M  V30 6 1 6 11
M  V30 7 1 7 12
M  V30 8 1 8 9
M  V30 9 1 8 10
M  V30 10 1 9 11
M  V30 11 1 10 12
M  V30 12 1 11 12
M  V30 END BOND
M  V30 END CTAB
M  END
> <cas.rn>
107729-45-3

> <cas.index.name>
Phosphonic acid, P-(1,5-dihydroxy-2-oxo-3-pyrrolidinyl)-

> <molecular.formula>
C4H8NO6P

> <molecular.weight>
197.08

> <boiling.point.predicted>
588.1±60.0 °C    Press: 760 Torr

> <density.predicted>
2.01±0.1 g/cm3    Temp: 20 °C; Press: 760 Torr

> <pka.predicted>
1.25±0.40    Most Acidic Temp: 25 °C

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