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Methyl 4-fluorobenzoate

Methyl 4-fluorobenzoate structure

CAS No:
403-33-8
Formula:
C8H7FO2
Chemical Name:
Methyl 4-fluorobenzoate
Synonyms:
Benzoic acid,4-fluoro-,methyl ester;Benzoic acid,p-fluoro-,methyl ester;Methyl 4-fluorobenzoate;Methyl p-fluorobenzoate;4-Fluorobenzoic acid methyl ester;NSC 102770;4-Methoxycarbonyl-1-fluorobenzene
Categories:
Organic Chemistry > Organic Fluorine Compound

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Description

Colorless liquid

Methyl 4-fluorobenzoate Basic Attributes

Molecular Weight：

154.14

Exact Mass：

154.14

BRN：

2085925

EC Number：

206-956-7

NSC Number：

102770

DSSTox ID：

DTXSID40193309

HScode：

2916399090

Characteristics

PSA：

26.3

XLogP3：

2.3

Density：

1.2±0.1 g/cm3

Melting Point：

4.5 °C

Boiling Point：

197 °C

Flash Point：

172 °F

Refractive Index：

1.490

Safety Information

Hazard category：

IRRITANT

wgk germany：

hazard class code：

22-37/38-41-36/38

safety instructions：

26-36/39-36

Marks：

Xn,T,Xi

Hazard note：

Toxic

Precautionary statement(s)：

P261-P280-P305 + P351 + P338

Hazard Statements：

H302-H315-H318-H335

Computed Properties

Molecular Weight:154.14
XLogP3:2.3
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:2
Exact Mass:154.04300762
Monoisotopic Mass:154.04300762
Topological Polar Surface Area:26.3
Heavy Atom Count:11
Complexity:139
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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