Cas no 458-45-7 (3-(3-Fluorophenyl)propionic acid)

3-(3-Fluorophenyl)propionic acid structure
458-45-7 structure
Product Name:3-(3-Fluorophenyl)propionic acid
CAS No:458-45-7
MF:C9H9FO2
MW:168.164966344833
MDL:MFCD01310821
CID:37542
PubChem ID:2737489
Update Time:2025-04-18

3-(3-Fluorophenyl)propionic acid Chemical and Physical Properties

Names and Identifiers

    • 3-(3-Fluorophenyl)propionic acid
    • 3-(3-fluorophenyl)propanoic acid
    • 004851
    • 3-(3-Fluoro-phenyl)-propionic acid
    • 3-(3-Fluor-phenyl)-propionsaeure
    • 3-(m-fluorophenyl)propanoic acid
    • 3-Fluorohydrocinnamic acid
    • 3-fluorophenylpropionic acid
    • AC1MC7DZ
    • AG-F-58474
    • PubChem13947
    • SBB010231
    • ZERO
    • ZERO/004851
    • 3-Fluorobenzenepropanoic acid
    • Benzenepropanoic acid,3-fluoro-
    • UBLMRADOKLXLCD-UHFFFAOYSA-N
    • 3-(3-Fluorophenyl) propionic acid
    • STK689316
    • 3-FLUORO-BENZENEPROPANOIC ACID
    • Z185153196
    • MFCD01310821
    • 458-45-7
    • CS-W017812
    • W-200381
    • BB 0217990
    • GEO-01431
    • AKOS000206785
    • FT-0632160
    • BENZENEPROPANOIC ACID, 3-FLUORO-
    • AC-14115
    • F0779
    • PS-6446
    • SY017727
    • 3-(3-Fluorophenyl)propionic acid, 97%
    • AM20040514
    • EN300-24320
    • DTXSID20372094
    • AB08454
    • SCHEMBL334758
    • A826905
    • DB-021628
    • DTXCID20323127
    • 626-825-1
    • MDL： MFCD01310821
    • Inchi： 1S/C9H9FO2/c10-8-3-1-2-7(6-8)4-5-9(11)12/h1-3,6H,4-5H2,(H,11,12)
    • InChI Key： UBLMRADOKLXLCD-UHFFFAOYSA-N
    • SMILES： FC1=CC=CC(=C1)CCC(=O)O

Computed Properties

  • Exact Mass: 168.05867
  • Monoisotopic Mass: 168.059
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 12
  • Rotatable Bond Count: 3
  • Complexity: 159
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Surface Charge: 0
  • Tautomer Count: nothing
  • XLogP3: 1.8
  • Topological Polar Surface Area: 37.3

Experimental Properties

  • Color/Form: White crystals
  • Density: 1.222
  • Melting Point: 41.0 to 45.0 deg-C
  • Boiling Point: 119°C/0.4mmHg(lit.)
  • Flash Point: Degrees Fahrenheit:230°F
    Degrees Celsius:110°C
  • Refractive Index: 1.522
  • PSA: 37.3
  • LogP: 1.84290
  • Solubility: Not determined

3-(3-Fluorophenyl)propionic acid Security Information

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Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
SHANG HAI MAI KE LIN SHENG HUA Technology Co., Ltd.
F837163-25g
3-(3-Fluorophenyl)propionic Acid
 458-45-7 >95%
25g
 1,443.00 2021-05-17
SHANG HAI MAI KE LIN SHENG HUA Technology Co., Ltd.
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3-(3-Fluorophenyl)propionic Acid
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XI GE MA AO DE LI QI （ SHANG HAI ） MAO YI Co., Ltd.
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 ￥353.76 2022-02-24
TRC
F632288-50mg
3-(3-Fluorophenyl)propionic Acid
 458-45-7
50mg
 $ 50.00 2022-06-04
TRC
F632288-100mg
3-(3-Fluorophenyl)propionic Acid
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100mg
 $ 65.00 2022-06-04
TRC
F632288-500mg
3-(3-Fluorophenyl)propionic Acid
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500mg
 $ 80.00 2022-06-04
SHANG HAI YI EN HUA XUE JI SHU Co., Ltd.
R013757-1g
3-(3-Fluorophenyl)propionic acid
 458-45-7 97%
1g
 ￥29 2024-05-23
SHANG HAI YI EN HUA XUE JI SHU Co., Ltd.
R013757-5g
3-(3-Fluorophenyl)propionic acid
 458-45-7 97%
5g
 ￥700 2021-08-25
SHANG HAI JI ZHI SHENG HUA Technology Co., Ltd.
F52820-1g
3-(3-Fluorophenyl)propionic acid
 458-45-7 97%
1g
 ￥29.0 2023-09-07
SHANG HAI JI ZHI SHENG HUA Technology Co., Ltd.
F52820-5g
3-(3-Fluorophenyl)propionic acid
 458-45-7 97%
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 ￥117.0 2023-09-07

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