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Methyl5-chloro-2-(trifluoroMethylsulfonaMido)benzoate

Methyl5-chloro-2-(trifluoroMethylsulfonaMido)benzoate structure

CAS No:
84466-05-7
Formula:
C9H7ClF3NO4S
Chemical Name:
Methyl5-chloro-2-(trifluoroMethylsulfonaMido)benzoate
Synonyms:
Methyl 5-chloro-2-(trifluoroMethylsulfonaMido)benzoate;5-Chloro-2-{[(trifluoromethyl)sulfonyl]amino}benzoic acid methyl ester;Amidoflumet;Methyl 5-chloro-2-{[(trifluoromethyl)sulfonyl]amino}benzoate;Benzoic acid, 5-chloro-2-[[(trifluoromethyl)sulfonyl]amino]-, methyl ester

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Methyl5-chloro-2-(trifluoroMethylsulfonaMido)benzoate Basic Attributes

Molecular Weight：

317.67

Exact Mass：

316.9736411

UNII：

N8D88V49HD

DSSTox ID：

DTXSID9057842

Characteristics

PSA：

80.85000

XLogP3：

3.54190

Density：

1.619±0.06 g/cm3

Melting Point：

80.7 °C

Boiling Point：

348.3±52.0 °C(Predicted)

Flash Point：

164.434ºC

Refractive Index：

1.525

PKA：

2.92±0.10

Safety Information

Transport codes：

UN2811 - class 6.1 - PG 3 - EHS - Toxic solids, organic, n.o.s., HI: all

wgk germany：

hazard class code：

25-51/53

safety instructions：

45-61

Marks：

T,N

Computed Properties

Molecular Weight:317.67
XLogP3:3.7
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:4
Exact Mass:316.9736411
Monoisotopic Mass:316.9736411
Topological Polar Surface Area:80.8
Heavy Atom Count:19
Complexity:434
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of Methyl5-chloro-2-(trifluoroMethylsulfonaMido)benzoate

Basic Attributes
Characteristics
Safety Information
Computed Properties

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