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Pyridazine-3-thiol

Pyridazine-3-thiol structure

CAS No:
28544-77-6
Formula:
C4H4N2S
Chemical Name:
Pyridazine-3-thiol
Synonyms:
Pyridazine-3-thiol;3(2H)-Pyridazinethione;1H-pyridazine-6-thione
Categories:
Chemical Reagents > Organic Reagents

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Pyridazine-3-thiol Basic Attributes

Molecular Weight：

112.15

Exact Mass：

112.01000

NSC Number：

252187

DSSTox ID：

DTXSID60394639

Characteristics

PSA：

56.5

XLogP3：

1.13920

Density：

1.3g/cm3

Melting Point：

170 °C(Solv: ethanol (64-17-5))

Boiling Point：

191.3ºC at 760 mmHg

Flash Point：

69.5ºC

Refractive Index：

1.662

Vapor Pressure：

0.519mmHg at 25°C

Safety Information

GHS Classification：

|Warning|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P312, P304+P340, P305+P351+P338, P312, P321, P322, P330, P332+P313, P337+P313, P362, P363, P403+P233, P405, and P501|The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

Computed Properties

Molecular Weight:112.16
XLogP3:-0.1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Exact Mass:112.00951931
Monoisotopic Mass:112.00951931
Topological Polar Surface Area:56.5
Heavy Atom Count:7
Complexity:137
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes