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1-Oxo-4-hydroxymethyl-2,6,7-trioxa-1-phosphabicyclo[2.2.2]octane

1-Oxo-4-hydroxymethyl-2,6,7-trioxa-1-phosphabicyclo[2.2.2]octane structure

CAS No:
5301-78-0
Formula:
C5H9O5P
Chemical Name:
1-Oxo-4-hydroxymethyl-2,6,7-trioxa-1-phosphabicyclo[2.2.2]octane
Synonyms:
2,6,7-Trioxa-1-phosphabicyclo[2.2.2]octane-4-methanol,1-oxide;Pentaerythritol,cyclic phosphate (1:1);Pentaerythritol,cyclic phosphate;4-(Hydroxymethyl)-1-oxido-2,6,7-trioxa-1-phosphabicyclo[2.2.2]octane;Pentaerythritol phosphate alcohol;CN 1137;2,6,7-Trioxaphosphobicyclo[2.2.2]octane-4-methanol 1-oxide;NH 1197;PEPA;1-Oxo-4-hydroxymethyl-2,6,7-trioxa-1-phosphabicyclo[2.2.2]octane
Categories:
Pharmaceutical Intermediates > Bulk Drug Intermediates

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1-Oxo-4-hydroxymethyl-2,6,7-trioxa-1-phosphabicyclo[2.2.2]octane Basic Attributes

Molecular Weight：

180.096

Exact Mass：

180.10

EC Number：

610-937-2

DSSTox ID：

DTXSID20201057

HScode：

2909499000

Characteristics

PSA：

74.80000

XLogP3：

-1.08

Density：

1.5±0.1 g/cm3

Melting Point：

207.4-214.0 °C

Boiling Point：

270.9±9.0 °C at 760 mmHg

Flash Point：

117.6±18.7 °C

Refractive Index：

1.503

Safety Information

Precautionary statement(s)：

P273, P501

Hazard Statements：

H413

GHS Classification：

H413 (100%): May cause long lasting harmful effects to aquatic life [Hazardous to the aquatic environment, long-term hazard]|P273, and P501|Aggregated GHS information provided by 47 companies from 1 notifications to the ECHA C&L Inventory.

1-Oxo-4-hydroxymethyl-2,6,7-trioxa-1-phosphabicyclo[2.2.2]octane Use and Manufacturing

suzuki reaction

Computed Properties

Molecular Weight:180.10
XLogP3:-1.5
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:1
Exact Mass:180.01876038
Monoisotopic Mass:180.01876038
Topological Polar Surface Area:65
Heavy Atom Count:11
Complexity:184
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Latest News on 1-Oxo-4-hydroxymethyl-2,6,7-trioxa-1-phosphabicyclo[2.2.2]octane

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Guide of 1-Oxo-4-hydroxymethyl-2,6,7-trioxa-1-phosphabicyclo[2.2.2]octane

Basic Attributes
Characteristics
Safety Information
Use and Manufacturing
Computed Properties
Latest News
Learn More Other Chemicals

1-Oxo-4-hydroxymethyl-2,6,7-trioxa-1-phosphabicyclo[2.2.2]octane

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