Cas no 628-46-6 (5-methylhexanoic acid)

5-methylhexanoic acid structure
5-methylhexanoic acid structure
Product Name:5-methylhexanoic acid
CAS No:628-46-6
MF:C7H14O2
MW:130.184862613678
MDL:MFCD00036494
CID:82830
PubChem ID:12344
Update Time:2025-04-18

5-methylhexanoic acid Chemical and Physical Properties

Names and Identifiers

    • 5-methylhexanoic acid
    • 5-methyl-caproic acid
    • 5-methyl-hexanoic acid
    • 5-methyl-hexanoicaci
    • 5-methylhexylicacid
    • dimethyl pentanoic acid
    • FEMA 3572
    • FEMA NUMBER 3572
    • i-heptanoic acid
    • Isoamylaceric acid
    • ISOAMYLACETIC ACID
    • isoenanthicacid
    • isoheptanoic acid
    • isoheptylic acid
    • iso-hexanoic acid
    • MDL： MFCD00036494
    • Inchi： 1S/C7H14O2/c1-6(2)4-3-5-7(8)9/h6H,3-5H2,1-2H3,(H,8,9)
    • InChI Key： MHPUGCYGQWGLJL-UHFFFAOYSA-N
    • SMILES： CC(CCCC(=O)O)C

Computed Properties

  • Exact Mass: 130.09900
  • Monoisotopic Mass: 130.09938
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 9
  • Rotatable Bond Count: 4
  • Complexity: 86.9
  • 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: nothing
  • Topological Polar Surface Area: 37.3

Experimental Properties

  • Color/Form: Colorless liquid
  • Density: 0,91 g/cm3
  • Melting Point: -55.77°C (estimate)
  • Boiling Point: 216°C
  • Flash Point: >100°C
  • Refractive Index: 1.4220
  • Water Partition Coefficient: Slightly soluble in water.
  • PSA: 37.30000
  • LogP: 1.89730
  • FEMA: 3572 | 5-METHYLHEXANOIC ACID
  • Solubility: Slightly soluble in water.

5-methylhexanoic acid Security Information

5-methylhexanoic acid Pricemore >>

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5-methylhexanoic acid Suppliers

Tiancheng Chemical (Jiangsu) Co., Ltd
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(CAS:628-46-6)5-Methylhexanoic Acid
Order Number:LE16081
Stock Status:in Stock
Quantity:25KG,200KG,1000KG
Purity:99%
Pricing Information Last Updated:Friday, 20 June 2025 12:13
Price ($):discuss personally

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Tiancheng Chemical (Jiangsu) Co., Ltd
(CAS:628-46-6)5-Methylhexanoic Acid
LE16081
Purity:99%
Quantity:25KG,200KG,1000KG
Price ($):Inquiry
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