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5,5''-dibromo-[2,2':5',2"]terthiohene

5,5''-dibromo-[2,2':5',2"]terthiohene structure

CAS No:
98057-08-0
Formula:
C12H6Br2S3
Chemical Name:
5,5''-dibromo-[2,2':5',2"]terthiohene
Synonyms:
2,5-Bis(5-bromothiophen-2-yl)thiophene;5,5μμ-Dibromo-2,2μ:5μ,2μμ-terthiophene;2,5-Bis(5-broMo-2-thienyl)thiophene;5,5''-Dibromo-alpha-terthienyl;5,5''-Dibromo-2,2':5',2''-terthiophene 97%;5',2"]terthiohene;5,5''-dibromo-[2,2'
Categories:
Pharmaceutical Intermediates > Heterocyclic Compound

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5,5''-dibromo-[2,2':5',2"]terthiohene Basic Attributes

Molecular Weight：

406.185

Exact Mass：

403.799835

UNII：

HI93T94CTM

NSC Number：

700236

DSSTox ID：

DTXSID70243407

HScode：

2934999090

Characteristics

PSA：

84.7

XLogP3：

6.4

Density：

1.8±0.1 g/cm3

Melting Point：

150-155 °C

Boiling Point：

417.2ºC at 760mmHg

Flash Point：

206.1±27.3 °C

Refractive Index：

1.707

Safety Information

Packing level：

Ⅲ

Transport codes：

UN28116.1/PG3

wgk germany：

hazard class code：

25-37/38-41

safety instructions：

26-45

Marks：

Precautionary statement(s)：

P261-P280-P301 + P310-P305 + P351 + P338

Hazard Statements：

H301-H315-H318-H335

GHS Classification：

|Danger|H301 (100%): Toxic if swallowed [Danger Acute toxicity, oral]|P261, P264, P270, P271, P280, P301+P310, P302+P352, P304+P340, P305+P351+P338, P310, P312, P321, P330, P332+P313, P362, P403+P233, P405, and P501|Aggregated GHS information provided by 38 companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Computed Properties

Molecular Weight:406.2
XLogP3:6.4
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:2
Exact Mass:405.79779
Monoisotopic Mass:403.79984
Topological Polar Surface Area:84.7
Heavy Atom Count:17
Complexity:251
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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CAS No.: 98057-08-0

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Guide of 5,5''-dibromo-[2,2':5',2"]terthiohene

Basic Attributes
Characteristics
Safety Information
Computed Properties
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5,5''-dibromo-[2,2':5',2"]terthiohene

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