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2-bromo-3-hydroxy-6-(hydroxymethyl)pyran-4-one

2-bromo-3-hydroxy-6-(hydroxymethyl)pyran-4-one structure

CAS No:
40838-32-2
Formula:
C6H5BrO4
Chemical Name:
2-bromo-3-hydroxy-6-(hydroxymethyl)pyran-4-one
Synonyms:
6-bromo-5-hydroxy-2-hydroxymethyl-4H-pyran-4-one; 6-BROMO-5-HYDROXY-2-HYDROXYMETHYL-4-PYRANONE; 2-Brom-3-hydroxy-6-hydroxymethyl-pyran-4-on; 2-bromo-3-hydroxy-6-(hydroxymethyl)-4h-pyran-4-one; 6-Bromkojic-saeure; 2-bromokojic acid; 2-bromo-3-hydroxy-6-hydroxymethyl-pyran-4-one;Expand

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2-bromo-3-hydroxy-6-(hydroxymethyl)pyran-4-one Basic Attributes

Molecular Weight：

221.00500

Exact Mass：

219.93712 g/mol

NSC Number：

175292

DSSTox ID：

DTXSID30193818

HScode：

2932999099

Characteristics

PSA：

70.67000

XLogP3：

0.60020

Density：

2.115g/cm3

Boiling Point：

377.6ºC

Flash Point：

182.1ºC

Refractive Index：

1.682

Drug Information

MeSH Entry Terms：

6-bromo-5-HOHMeP

Computed Properties

Molecular Weight:221.01
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:1
Exact Mass:219.93712
Monoisotopic Mass:219.93712
Topological Polar Surface Area:66.8
Heavy Atom Count:11
Complexity:253
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 2-bromo-3-hydroxy-6-(hydroxymethyl)pyran-4-one

Basic Attributes
Characteristics
Drug Information
Computed Properties

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