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2,3-Dichlorobenzenethiol

2,3-Dichlorobenzenethiol structure

CAS No:
17231-95-7
Formula:
C6H4Cl2S
Chemical Name:
2,3-Dichlorobenzenethiol
Synonyms:
Benzenethiol,2,3-dichloro-;2,3-Dichlorobenzenethiol;2,3-Dichlorothiophenol
Categories:
Chemical Reagents > Organic Reagents

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Description

white to slightly yellow crystals

2,3-Dichlorobenzenethiol Basic Attributes

Molecular Weight：

179.07

Exact Mass：

179.07

BRN：

2043616

EC Number：

-0

DSSTox ID：

DTXSID70169254

HScode：

29309090

Characteristics

PSA：

XLogP3：

3.73

Appearance：

solid

Density：

1.3905 (estimate)

Melting Point：

46.5 °C

Boiling Point：

96-98 °C (0.5 mmHg)

Flash Point：

>230 °F

Refractive Index：

1.620

Vapor Pressure：

0.0364mmHg at 25°C

Safety Information

Packing level：

III

Hazard category：

IRRITANT, STENCH

Transport codes：

2811

wgk germany：

hazard class code：

22-41-36/37/38

safety instructions：

26-36/39-37/39

Marks：

Xn,Xi

Hazard note：

Irritant/Stench

Precautionary statement(s)：

P280-P305 + P351 + P338

Hazard Statements：

H302-H318

GHS Classification：

|Danger|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P310, P312, P321, P330, P332+P313, P337+P313, P362, 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.

Computed Properties

Molecular Weight:179.07
XLogP3:3.7
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:1
Exact Mass:177.9410767
Monoisotopic Mass:177.9410767
Topological Polar Surface Area:1
Heavy Atom Count:9
Complexity:97.1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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2,3-Dichlorothiophenol

CAS No.: 17231-95-7

Content: 99.00%

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CAS No.: 17231-95-7

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