 Home > Encyclopedia > 5-[[5-hydroxy-4-(hydroxymethyl)-6-methylpyridin-3-yl]methylsulfanylmethyl]-4-(hydroxymethyl)-2-methylpyridin-3-ol,hydrate,dihydrochloride

5-[[5-hydroxy-4-(hydroxymethyl)-6-methylpyridin-3-yl]methylsulfanylmethyl]-4-(hydroxymethyl)-2-methylpyridin-3-ol,hydrate,dihydrochloride

5-[[5-hydroxy-4-(hydroxymethyl)-6-methylpyridin-3-yl]methylsulfanylmethyl]-4-(hydroxymethyl)-2-methylpyridin-3-ol,hydrate,dihydrochloride structure

CAS No:
74050-94-5
Formula:
C16H24Cl2N2O5S
Chemical Name:
5-[[5-hydroxy-4-(hydroxymethyl)-6-methylpyridin-3-yl]methylsulfanylmethyl]-4-(hydroxymethyl)-2-methylpyridin-3-ol,hydrate,dihydrochloride

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5-[[5-hydroxy-4-(hydroxymethyl)-6-methylpyridin-3-yl]methylsulfanylmethyl]-4-(hydroxymethyl)-2-methylpyridin-3-ol,hydrate,dihydrochloride Basic Attributes

Molecular Weight：

427.34300

Exact Mass：

426.0782984

DSSTox ID：

DTXSID80224949

Characteristics

PSA：

141.23000

XLogP3：

3.46230

Boiling Point：

718ºC at 760 mmHg

Flash Point：

388ºC

Computed Properties

Molecular Weight:427.3
Hydrogen Bond Donor Count:7
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:6
Exact Mass:426.0782984
Monoisotopic Mass:426.0782984
Topological Polar Surface Area:133
Heavy Atom Count:26
Complexity:331
Covalently-Bonded Unit Count:4
Compound Is Canonicalized:Yes

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Guide of 5-[[5-hydroxy-4-(hydroxymethyl)-6-methylpyridin-3-yl]methylsulfanylmethyl]-4-(hydroxymethyl)-2-methylpyridin-3-ol,hydrate,dihydrochloride

Basic Attributes
Characteristics
Computed Properties

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