Cas no 1501-05-9 (5-Oxo-5-phenylpentanoic acid)

5-Oxo-5-phenylpentanoic acid is a versatile organic compound characterized by a phenyl-substituted ketone and a carboxylic acid functional group. Its structure makes it a valuable intermediate in organic synthesis, particularly for the preparation of pharmaceuticals, agrochemicals, and specialty chemicals. The ketone and carboxyl groups offer reactive sites for further derivatization, enabling applications in condensation reactions, esterifications, and amide formations. Its well-defined molecular framework ensures consistent reactivity, making it suitable for research and industrial processes requiring precise chemical transformations. The compound’s stability under standard conditions facilitates handling and storage, while its purity is critical for reproducible results in synthetic workflows.
5-Oxo-5-phenylpentanoic acid structure
5-Oxo-5-phenylpentanoic acid structure
Product Name:5-Oxo-5-phenylpentanoic acid
CAS No:1501-05-9
MF:C11H12O3
MW:192.211183547974
MDL:MFCD00004411
CID:83725
PubChem ID:73914
Update Time:2025-06-07

5-Oxo-5-phenylpentanoic acid Chemical and Physical Properties

Names and Identifiers

    • 5-Oxo-5-phenylpentanoic acid
    • 4-BENZOYLBUTYRIC ACID
    • 5-Oxo-5-phenylvaleric acid
    • AKOS BB-9265
    • TIMTEC-BB SBB007811
    • 4-Benzoylbutanoic acid
    • δ-Oxobenzenevaleric acid
    • 5-oxo-5-Phenyvaleic acidl
    • 4-(4'-benzoyl)butyric acid
    • LABOTEST-BB LT00645576
    • 4-Benzoylbutyric acid,97%
    • A809007
    • ChemDiv3_000839
    • SCHEMBL503304
    • NS00024906
    • NSC 10139
    • InChI=1/C11H12O3/c12-10(7-4-8-11(13)14)9-5-2-1-3-6-9/h1-3,5-6H,4,7-8H2,(H,13,14)
    • MFCD00004411
    • 4-Benzoylbutyric acid;4-Benzoylbutanoic acid
    • Z361415342
    • BRD-K86245308-001-01-0
    • .DELTA.-OXOBENZENEPENTANOIC ACID
    • AP-406/42754026
    • NSC10139
    • 5-Oxo-5-phenylvaleric acid, 96%
    • B2768
    • CS-W004848
    • .GAMMA.-BENZOYLBUTYRIC ACID
    • 1501-05-9
    • NSC-10139
    • FT-0600844
    • STR04963
    • SHKWSBAVRQZYLE-UHFFFAOYSA-
    • IDI1_019805
    • NCGC00341423-01
    • HMS1475G03
    • delta-oxobenzenepentanoic acid
    • F0722-1840
    • UNII-595CFD21KA
    • 5-phenyl-5-oxopentanoic acid
    • Benzenepentanoic acid, delta-oxo-
    • 4-BenzoYl-Butyric Acid
    • 5-PHENYL-5-OXOVALERIC ACID
    • Q63399605
    • 4-benzoylbutyrate
    • DTXSID50164469
    • Benzenepentanoic acid, .delta.-oxo-
    • SY023883
    • AB01332132-02
    • BUTYRIC ACID, 4-BENZOYL-
    • 595CFD21KA
    • EU-0001968
    • W-108078
    • Oprea1_086414
    • SR-01000403987-1
    • AMY10729
    • 5-keto-5-phenyl-valeric acid
    • AKOS000813948
    • 5-Oxo-5-phenylpentanoic acid #
    • EN300-178724
    • EINECS 216-113-5
    • SR-01000403987
    • GAMMA-BENZOYLBUTYRIC ACID
    • BUTANOIC ACID, 4-BENZOYL-
    • STK386172
    • DB-006665
    • DTXCID1086960
    • Benzenepentanoic acid, delta-oxo-(9CI)
    • MDL: MFCD00004411
    • Inchi: 1S/C11H12O3/c12-10(7-4-8-11(13)14)9-5-2-1-3-6-9/h1-3,5-6H,4,7-8H2,(H,13,14)
    • InChI Key: SHKWSBAVRQZYLE-UHFFFAOYSA-N
    • SMILES: O=C(C1C=CC=CC=1)CCCC(=O)O
    • BRN: 641947

Computed Properties

  • Exact Mass: 192.07900
  • Monoisotopic Mass: 192.079
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 14
  • Rotatable Bond Count: 5
  • Complexity: 205
  • 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: 2
  • XLogP3: nothing
  • Topological Polar Surface Area: 54.4A^2

Experimental Properties

  • Color/Form: White or cream solid.
  • Density: 1.164
  • Melting Point: 125.0 to 130.0 deg-C
  • Boiling Point: 380.8℃ at 760 mmHg
  • Flash Point: 198.3 °C
  • Refractive Index: 1.539
  • Water Partition Coefficient: Insoluble in water.
  • PSA: 54.37000
  • LogP: 2.12420
  • Solubility: Insoluble in water.

5-Oxo-5-phenylpentanoic acid Security Information

  • Symbol: GHS07
  • Prompt:warning
  • Signal Word:Warning
  • Hazard Statement: H315-H319-H335
  • Warning Statement: P261-P305 + P351 + P338
  • Hazardous Material transportation number:NONH for all modes of transport
  • WGK Germany:3
  • Hazard Category Code: 36/37/38
  • Safety Instruction: S26-S36
  • Hazardous Material Identification: Xi
  • Risk Phrases:R36/37/38

5-Oxo-5-phenylpentanoic acid Customs Data

  • HS CODE:2918300090
  • Customs Data:

    China Customs Code:

    2918300090

    Overview:

    2918300090 Other aldehydes or ketones without other oxy carboxylic acids(Including anhydrides\Acyl halide\Peroxides, peroxyacids and derivatives of this tax number). VAT:17.0% Tax refund rate:9.0% Regulatory conditions:nothing MFN tariff:6.5% general tariff:30.0%

    Declaration elements:

    Product Name, component content, use to

    Summary:

    2918300090 other carboxylic acids with aldehyde or ketone function but without other oxygen function, their anhydrides, halides, peroxides, peroxyacids and their derivatives.Supervision conditions:None.VAT:17.0%.Tax rebate rate:9.0%.MFN tariff:6.5%.General tariff:30.0%

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5-Oxo-5-phenylpentanoic acid Production Method

5-Oxo-5-phenylpentanoic acid Suppliers

Tiancheng Chemical (Jiangsu) Co., Ltd
Gold Member
Audited Supplier Audited Supplier
(CAS:1501-05-9)4-苯甲酰丁酸
Order Number:LE2468669
Stock Status:in Stock
Quantity:25KG,200KG,1000KG
Purity:99%
Pricing Information Last Updated:Friday, 20 June 2025 12:38
Price ($):discuss personally

5-Oxo-5-phenylpentanoic acid Related Literature

Recommended suppliers
Tiancheng Chemical (Jiangsu) Co., Ltd
(CAS:1501-05-9)4-苯甲酰丁酸
LE2468669
Purity:99%
Quantity:25KG,200KG,1000KG
Price ($):Inquiry
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