Cas no 833-85-2 (5-(4-Methylphenyl)-5-oxovaleric Acid)

5-(4-Methylphenyl)-5-oxovaleric Acid structure
833-85-2 structure
Product Name:5-(4-Methylphenyl)-5-oxovaleric Acid
CAS No:833-85-2
MF:C12H14O3
MW:206.237763881683
MDL:MFCD00458564
CID:728045
PubChem ID:70032
Update Time:2025-04-19

5-(4-Methylphenyl)-5-oxovaleric Acid Chemical and Physical Properties

Names and Identifiers

    • Benzenepentanoic acid,4-methyl-d-oxo-
    • 5-(4-Methylphenyl)-5-oxovaleric acid
    • 5-Oxo-5-p-tolyl-pentanoic acid
    • MCWLCBLXRSXGTF-UHFFFAOYSA-N
    • Butyric acid, 4-p-toluoyl-
    • 4-p-Toluoylbutyric acid
    • DA8HTW3SB7
    • EN300-138548
    • 5-(4-Methylphenyl)-5-oxopentanoic acid #
    • doi:10.14272/MCWLCBLXRSXGTF-UHFFFAOYSA-N
    • FT-0705961
    • FS-4187
    • AKOS004908134
    • 833-85-2
    • 4-p-toluoylbutyricacid
    • EINECS 212-632-6
    • 5-Oxo-5-(p-tolyl)pentanoic acid
    • Benzenepentanoic acid, 4-methyl-delta-oxo-
    • MFCD00458564
    • AB06076
    • 4-methyl-delta-oxobenzenepentanoic acid
    • 5-oxo-5-p-tolylpentanoic acid
    • Z361415418
    • SCHEMBL2743310
    • Benzenepentanoic acid, 4-methyl-.delta.-oxo-
    • 4-(p-Toluoyl)butyric acid
    • 10.14272/MCWLCBLXRSXGTF-UHFFFAOYSA-N
    • 5-(4-Methylphenyl)-5-oxopentanoic acid
    • NS00038252
    • DTXSID90232257
    • DB-075925
    • STL301504
    • 5-(4-Methylphenyl)-5-oxovaleric Acid
    • MDL： MFCD00458564
    • Inchi： 1S/C12H14O3/c1-9-5-7-10(8-6-9)11(13)3-2-4-12(14)15/h5-8H,2-4H2,1H3,(H,14,15)
    • InChI Key： MCWLCBLXRSXGTF-UHFFFAOYSA-N
    • SMILES： O=C(C1C=CC(C)=CC=1)CCCC(=O)O

Computed Properties

  • Exact Mass: 206.094294
  • Monoisotopic Mass: 206.094294
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 15
  • Rotatable Bond Count: 5
  • Complexity: 227
  • 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
  • XLogP3: 2.1
  • Topological Polar Surface Area: 54.4

Experimental Properties

  • Density: 1.137
  • Boiling Point: 399.5°C at 760 mmHg
  • Flash Point: 209.6°C
  • Refractive Index: 1.536
  • PSA: 54.37000
  • LogP: 2.43260

5-(4-Methylphenyl)-5-oxovaleric Acid Pricemore >>

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
Fluorochem
022946-1g
5-(4-Methylphenyl)-5-oxovaleric acid
 833-85-2 95%
1g
 ￡10.00 2022-03-01
Fluorochem
022946-100g
5-(4-Methylphenyl)-5-oxovaleric acid
 833-85-2 95%
100g
 ￡933.00 2022-03-01
TRC
M328265-2.5g
5-(4-Methylphenyl)-5-oxovaleric Acid
 833-85-2
2.5g
 $ 135.00 2022-06-04
TRC
M328265-25g
5-(4-Methylphenyl)-5-oxovaleric Acid
 833-85-2
25g
 $ 1060.00 2022-06-04
SHANG HAI HAO HONG Biomedical Technology Co., Ltd.
1743316-1g
5-Oxo-5-(p-tolyl)pentanoic acid
 833-85-2 98%
1g
 ￥5616.00 2024-07-28
SHANG HAI HAO HONG Biomedical Technology Co., Ltd.
1743316-5g
5-Oxo-5-(p-tolyl)pentanoic acid
 833-85-2 98%
5g
 ￥1146.00 2024-04-28
eNovation Chemicals LLC
D410036-10g
4-p-toluoylbutyricacid
 833-85-2 95%+
10g
 $290 2025-02-20
A2B Chem LLC
AC39044-1g
5-Oxo-5-(p-tolyl)pentanoic acid
 833-85-2 95%
1g
 $40.00 2024-04-19
A2B Chem LLC
AC39044-5g
5-Oxo-5-(p-tolyl)pentanoic acid
 833-85-2 95%
5g
 $130.00 2024-04-19
A2B Chem LLC
AC39044-25g
5-Oxo-5-(p-tolyl)pentanoic acid
 833-85-2 95%
25g
 $390.00 2024-04-19

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