5-[4-(Benzyloxy)phenyl]-1H-pyrazole-3-carboxylic acid | CAS No. 795260-68-3

5-[4-(Benzyloxy)phenyl]-1H-pyrazole-3-carboxylic acid

Basic Information

CAS Number

795260-68-3

Molecular Formula

C17H14N2O3

Molecular Weight

294.31 g/mol

AD

Basic Physical Properties

Boiling Point

590.3±50.0°C at 760 mmHg

C1=CC=C(C=C1)COC2=CC=C(C=C2)C3=NNC(=C3)C(=O)O

InChI

InChI=1S/C17H14N2O3/c20-17(21)16-10-15(18-19-16)13-6-8-14(9-7-13)22-11-12-4-2-1-3-5-12/h1-10H,11H2,(H,18,19)(H,20,21)

InChIKey

JFCYETQEMDKJAU-UHFFFAOYSA-N

LogP

3.353900000000001

Topological Polar Surface Area

75.21000000000001 Ų

Hydrogen Bond Donor/Acceptor

2 / 5

Complexity

363

Safety Information

View Safety Information

Hazard Statement

H302 Harmful if swallowed
Acute toxicity, oral
H315 Causes skin irritation
Skin corrosion/irritation
H319 Causes serious eye irritation
Serious eye damage/eye irritation
H332 Harmful if inhaled
Acute toxicity, inhalation
H335 May cause respiratory irritation
Specific target organ toxicity, single exposure; Respiratory tract irritation

Synonyms & References

English

  • 3-(4-phenylmethoxyphenyl)-1H-pyrazole-5-carboxylic acid
  • AKOS015839387
  • 5-(4-Benzyloxyphenyl)-1H-pyrazole-3-carboxylic acid
  • CS-0326378
  • 5-[4-(benzyloxy)phenyl]-1H-pyrazole-3-carboxylic acid
  • SCHEMBL2819762
  • DS-0118
  • 3-[4-(benzyloxy)phenyl]-1H-pyrazole-5-carboxylic acid
  • A864847
  • DTXSID20394731
  • 795260-68-3
  • FT-0759986
  • 5-(4-(Benzyloxy)phenyl)-1H-pyrazole-3-carboxylic acid
  • 1H-Pyrazole-3-carboxylicacid, 5-[4-(phenylmethoxy)phenyl]-
  • 5-[4-(phenylmethoxy)phenyl]-1H-Pyrazole-3-carboxylic acid
  • RW2323

MDL Number

MFCD05170153

Customs Code

2933199090

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