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3-HYDROXY-2,6-BIS(HYDROXYMETHYL)-4-PYRONE

3-HYDROXY-2,6-BIS(HYDROXYMETHYL)-4-PYRONE structure

CAS No:
2029-49-4
Formula:
C7H8O5
Chemical Name:
3-HYDROXY-2,6-BIS(HYDROXYMETHYL)-4-PYRONE
Synonyms:
3-Hydroxy-2,6-bis(hydroxymethyl)-4-pyrone;3-hydroxy-2,6-bis(hydroxymethyl)-4H-pyran-4-one;3-hydroxy-2,6-bis(hydroxymethyl)pyran-4-one;Maybridge1_000150;MixCom1_000282;Oprea1_284151;ACMC-209f89;4H-Pyran-4-one, 3-hydroxy-2,6-bis(hydroxymethyl)-;SCHEMBL3558568;CTK4E3826

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3-HYDROXY-2,6-BIS(HYDROXYMETHYL)-4-PYRONE Basic Attributes

Molecular Weight：

172.13500

Exact Mass：

172.03700

DSSTox ID：

DTXSID90372682

HScode：

2932999099

Characteristics

PSA：

90.90000

XLogP3：

-1.2

Density：

1.583g/cm3

Boiling Point：

496.5ºC at 760 mmHg

Flash Point：

213.7ºC

Refractive Index：

1.617

Safety Information

hazard class code：

36/37/38

safety instructions：

26-36/37/39

Computed Properties

Molecular Weight:172.13
XLogP3:-1.2
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:2
Exact Mass:172.03717335
Monoisotopic Mass:172.03717335
Topological Polar Surface Area:87
Heavy Atom Count:12
Complexity:263
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 3-HYDROXY-2,6-BIS(HYDROXYMETHYL)-4-PYRONE

Basic Attributes
Characteristics
Safety Information
Computed Properties

3-HYDROXY-2,6-BIS(HYDROXYMETHYL)-4-PYRONE

SDS

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