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Benzene, 1,3-difluoro-5-isothiocyanato-

Benzene, 1,3-difluoro-5-isothiocyanato- structure

CAS No:
302912-39-6
Formula:
C7H3F2NS
Chemical Name:
Benzene, 1,3-difluoro-5-isothiocyanato-
Synonyms:
Benzene,1,3-difluoro-5-isothiocyanato-;1,3-Difluoro-5-isothiocyanatobenzene;3,5-Difluorophenylisothiocyanate
Categories:
Chemical Reagents > Organic Reagents

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Benzene, 1,3-difluoro-5-isothiocyanato- Basic Attributes

Molecular Weight：

171.1672264

Exact Mass：

171.17

DSSTox ID：

DTXSID60374279

HScode：

2930909090

Characteristics

PSA：

44.45000

XLogP3：

3.62

Density：

1.3±0.1 g/cm3

Boiling Point：

201-204 °C(lit.)

Flash Point：

85 °C

Refractive Index：

1.536

Safety Information

Transport codes：

UN 1760 8/PG 2

wgk germany：

hazard class code：

34-42

safety instructions：

26-27-36/37/39-45

Marks：

Precautionary statement(s)：

P260, P261, P264, P280, P285, P301+P330+P331, P303+P361+P353, P304+P340, P304+P341, P305+P351+P338, P310, P321, P342+P311, P363, P405, P501

Hazard Statements：

H314

GHS Classification：

|Danger|H314 (97.44%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]|P260, P261, P264, P280, P285, P301+P330+P331, P303+P361+P353, P304+P340, P304+P341, P305+P351+P338, P310, P321, P342+P311, P363, P405, and P501|Aggregated GHS information provided by 39 companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Computed Properties

Molecular Weight:171.17
XLogP3:3.5
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:1
Exact Mass:170.99542660
Monoisotopic Mass:170.99542660
Topological Polar Surface Area:44.4
Heavy Atom Count:11
Complexity:169
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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1,3-Difluoro-5-isothiocyanatobenzene

CAS No.: 302912-39-6

Content: 99.00%

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Guide of Benzene, 1,3-difluoro-5-isothiocyanato-

Basic Attributes
Characteristics
Safety Information
Computed Properties
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