3,4-Dichlorobenzoic acid | CAS No. 51-44-5

3,4-Dichlorobenzoic acid

Basic Information

CAS Number

51-44-5

Molecular Formula

C7H4Cl2O2

Molecular Weight

191.01 g/mol

AD

Basic Physical Properties

Melting Point

204-206?°C

Boiling Point

317.8°C at 760 mmHg

Water Solubility

insoluble

Flash Point

146°C

Refractive Index

1.4590 (estimate)

Vapor Pressure

0.000157mmHg at 25°C

C1=CC(=C(C=C1C(=O)O)Cl)Cl

InChI

InChI=1S/C7H4Cl2O2/c8-5-2-1-4(7(10)11)3-6(5)9/h1-3H,(H,10,11)

InChIKey

VPHHJAOJUJHJKD-UHFFFAOYSA-N

LogP

2.6916

Topological Polar Surface Area

37.3 Ų

Hydrogen Bond Donor/Acceptor

1 / 2

Complexity

161

Safety Information

View Safety Information

GHS Hazard Pictograms

H315H315
H319H319
H335H335

Hazard Statement

H315 Causes skin irritation
Skin corrosion/irritation
H319 Causes serious eye irritation
Serious eye damage/eye irritation
H335 May cause respiratory irritation
Specific target organ toxicity, single exposure; Respiratory tract irritation

Synonyms & References

English

  • CAS-51-44-5
  • NCGC00257876-01
  • BB 0221129
  • SCHEMBL371998
  • 3,4-Dichlorobenzoicacid
  • D0340
  • 3,4-DICHLOROBENZOIC ACID
  • 350818-53-0
  • NSC-17583
  • DTXSID9024980
  • NCGC00091648-02
  • Z104474098
  • WLN: QVR CG DG
  • MFCD00002492
  • NSC 17583
  • 3,4-DICHLOROBEZOIC ACID
  • Benzoic acid,4-dichloro-
  • BDBM50461950
  • AE-562/43459830
  • BENZOIC ACID,3,4-DICHLORO
  • NSC34414
  • CHEBI:49401
  • AC7846
  • 3,4-dichlorbenzoesyre
  • YS4ZR9BXWX
  • 3,4-dichloro benzoic acid
  • NSC17583
  • 3,4-Dichlorobenzoic acid, PESTANAL(R), analytical standard
  • DTXCID604980
  • Benzoic acid, 3,4-dichloro-
  • UNII-YS4ZR9BXWX

MDL Number

MFCD00002492

Customs Code

29163900

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