1-(Bromomethyl)-3-nitrobenzene | CAS No. 3958-57-4

1-(Bromomethyl)-3-nitrobenzene

Basic Information

CAS Number

3958-57-4

Molecular Formula

C7H6BrNO2

Molecular Weight

216.03 g/mol

AD

Basic Physical Properties

Melting Point

57.0 to 61.0 deg-C

Boiling Point

115°C/0.8mmHg

Flash Point

153-154°C/7mm

Refractive Index

1.6120 (estimate)

C1=CC(=CC(=C1)[N+](=O)[O-])CBr

InChI

InChI=1S/C7H6BrNO2/c8-5-6-2-1-3-7(4-6)9(10)11/h1-4H,5H2

InChIKey

LNWXALCHPJANMJ-UHFFFAOYSA-N

LogP

2.489700000000001

Topological Polar Surface Area

43.14 Ų

Hydrogen Bond Donor/Acceptor

0 / 3

Complexity

146

Safety Information

View Safety Information

GHS Hazard Pictograms

H314H314
H335H335

Hazard Statement

H314 Causes severe skin burns and eye damage
Skin corrosion/irritation
H335 May cause respiratory irritation
Specific target organ toxicity, single exposure; Respiratory tract irritation

Hazard Class

Class 8 Class 8

Synonyms & References

English

  • .alpha.-Bromo-m-nitrotoluene
  • BB 0218082
  • m-Nitro-.alpha.-bromotoluene
  • 3958-57-4
  • m-Nitro-alpha-bromotoluene
  • 3-Nitro-benzylbromid
  • 3-nitrophenylmethyl bromide
  • CS-W007452
  • 3-nitrobenzylbromide
  • 3-(Bromomethyl)nitrobenzene
  • MFCD00007271
  • A22366
  • 1-(Bromomethyl)-3-nitrobenzene;m-(Bromomethyl)nitrobenzene
  • 3-bromomethylnitrobenzene
  • AS-15868
  • InChI=1/C7H6BrNO2/c8-5-6-2-1-3-7(4-6)9(10)11/h1-4H,5H
  • 3-(bromomethyl)-1-nitrobenzene
  • 3-nitro-benzylbromide
  • a-bromo-m-nitrotoluene
  • NSC-66499
  • Toluene, .alpha.-bromo-m-nitro-
  • 1-Bromomethyl-3-nitrobenzene
  • AKOS025395650
  • Benzene, 1-(bromomethyl)-3-nitro-
  • AM20040372
  • Toluene, alpha-bromo-m-nitro-
  • 3-Nitrobenzyl bromide
  • 3-nitro benzyl bromide
  • 1-(Bromomethyl)-3-nitrobenzene #
  • 1-(Bromomethyl)-3-nitrobenzene
  • AKOS000121934

MDL Number

MFCD00007271

Customs Code

2904909090

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