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3-Fluoro-5-methylbenzonitrile

3-Fluoro-5-methylbenzonitrile structure

3-Fluoro-5-methylbenzonitrile 

structure
  • CAS No:

    216976-30-6

  • Formula:

    C8H6FN

  • Chemical Name:

    3-Fluoro-5-methylbenzonitrile

  • Synonyms:

    3-FLUORO-5-METHYLBENZONITRILE;Benzonitrile, 3-fluoro-5-methyl- (9CI);3-Fluoro-5-methylben;3-Cyano-5-fluorotoluene, 5-Fluoro-m-tolunitrile;Benzonitrile, 3-fluoro-5-methyl-

  • Categories:

    Organic Chemistry  >  Organic Fluorine Compound

Description

Off-white crystalline

3-Fluoro-5-methylbenzonitrile Basic Attributes

135.14

135.048431

DTXSID60380936

2926909090

Characteristics

23.8

2.1

1.1±0.1 g/cm3

53-56℃

88.7±12.1 °C

1.508

Safety Information

III

6.1

UN3439

T

Toxic

P261, P264, P270, P271, P280, P301+P310, P301+P312, P302+P352, P304+P312, P304+P340, P305+P351+P338, P312, P321, P322, P330, P332+P313, P337+P313, P361, P362, P363, P405, P501

H301

Computed Properties

Molecular Weight:135.14
XLogP3:2.1
Hydrogen Bond Acceptor Count:2
Exact Mass:135.048427358
Monoisotopic Mass:135.048427358
Topological Polar Surface Area:23.8
Heavy Atom Count:10
Complexity:158
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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