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1,3-Benzenedithiol

1,3-Benzenedithiol structure

CAS No:
626-04-0
Formula:
C6H6S2
Chemical Name:
1,3-Benzenedithiol
Synonyms:
1,3-Benzenedithiol;m-Benzenedithiol;1,3-Dimercaptobenzene;Dithioresorcinol;Thioresorcinol
Categories:
Chemical Reagents > Organic Reagents

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1,3-Benzenedithiol Basic Attributes

Molecular Weight：

142.24

Exact Mass：

142.24

BRN：

1634412

EC Number：

210-925-3

HScode：

2930909090

Characteristics

PSA：

XLogP3：

2.26400

Density：

1.24

Melting Point：

27 °C

Boiling Point：

245 °C

Flash Point：

>230 °F

Refractive Index：

1.665

Water Solubility：

Miscible with acetonitrile.

Safety Information

Packing level：

III

Transport codes：

UN 3335

wgk germany：

hazard class code：

37/38-41

safety instructions：

26-39

Marks：

Precautionary statement(s)：

P261-P280-P305 + P351 + P338

Hazard Statements：

H315-H318-H335

GHS Classification：

|Danger|H302 (11.36%): Harmful if swallowed [Warning Acute toxicity, oral]|P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P312, P304+P340, P305+P351+P338, P310, P312, P321, P322, P330, P332+P313, P362, P363, P403+P233, P405, and P501|Aggregated GHS information provided by 44 companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Drug Information

MeSH Entry Terms：

1,3-benzenedithiol

Computed Properties

Molecular Weight:142.2
XLogP3:2.2
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:2
Exact Mass:141.99109254
Monoisotopic Mass:141.99109254
Topological Polar Surface Area:2
Heavy Atom Count:8
Complexity:64.9
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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