Cas no 40463-09-0 (4-Methyl-1-phenylpentan-3-one)

4-Methyl-1-phenylpentan-3-one structure
4-Methyl-1-phenylpentan-3-one structure
Product Name:4-Methyl-1-phenylpentan-3-one
CAS No:40463-09-0
MF:C12H16O
MW:176.254843711853
CID:55226
PubChem ID:170307
Update Time:2025-04-18

4-Methyl-1-phenylpentan-3-one Chemical and Physical Properties

Names and Identifiers

    • 4-Methyl-1-phenylpentan-3-one
    • 3-Pentanone, 4-methyl-1-phenyl-; phenethyl isopropyl ketone; 4-Methyl-1-phenyl-3-pentanone; 2-methyl-5-phenyl-3-pentanone; AI3-21937; 4-methyl-1-phenyl-3-pentanone; AC1Q5H65; 2-methyl-5-phenylpentane-3-one; SureCN105766; AC1Q1NX4; AC1L55D9; 2-methyl-5-phenylpentan-3-one; 4-methyl-1-phenyl-pentan-3-one;
    • NS00030796
    • EINECS 254-930-9
    • 3-Pentanone, 4-methyl-1-phenyl-
    • SCHEMBL105766
    • DTXSID1068229
    • 4-Methyl-1-phenyl-3-pentanone
    • EN300-49836
    • CS-0250134
    • AI3-21937
    • J80Z7D1K94
    • Z406378608
    • AKOS008127249
    • UNII-J80Z7D1K94
    • QATHVLKLWVUSRC-UHFFFAOYSA-N
    • 2-METHYL-5-PHENYL-3-PENTANONE
    • 40463-09-0
    • 4-methyl-1-phenyl-pentan-3-one
    • G44873
    • DTXCID1039765
    • Inchi: 1S/C12H16O/c1-10(2)12(13)9-8-11-6-4-3-5-7-11/h3-7,10H,8-9H2,1-2H3
    • InChI Key: QATHVLKLWVUSRC-UHFFFAOYSA-N
    • SMILES: O=C(CCC1C=CC=CC=1)C(C)C

Computed Properties

  • Exact Mass: 176.120115130g/mol
  • Monoisotopic Mass: 176.120115130g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 1
  • Heavy Atom Count: 13
  • Rotatable Bond Count: 4
  • Complexity: 155
  • 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: 2.9
  • Topological Polar Surface Area: 17.1?2

4-Methyl-1-phenylpentan-3-one Pricemore >>

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
A2B Chem LLC
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A2B Chem LLC
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$174.00 2024-04-20
A2B Chem LLC
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A2B Chem LLC
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$407.00 2024-04-20
A2B Chem LLC
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A2B Chem LLC
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$1007.00 2024-04-20
A2B Chem LLC
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A2B Chem LLC
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Enamine
EN300-49836-0.05g
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$88.0 2025-03-21
Enamine
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