Cas no 54576-13-5 (Hexanedioic acid, 3-methyl-, dimethyl ester)

Hexanedioic acid, 3-methyl-, dimethyl ester structure
54576-13-5 structure
Product Name:Hexanedioic acid, 3-methyl-, dimethyl ester
CAS No:54576-13-5
MF:C9H16O4
MW:188.220943450928
CID:354205
PubChem ID:521519
Update Time:2025-07-22

Hexanedioic acid, 3-methyl-, dimethyl ester Chemical and Physical Properties

Names and Identifiers

    • Hexanedioic acid, 3-methyl-, dimethyl ester
    • 3-Methylhexanedioic acid dimethyl ester
    • dimethyl 3-methylhexanedioate
    • 3-Methyl-hexanedioic acid dimethyl ester
    • DTXSID00334670
    • 1,6-DIMETHYL 3-METHYLHEXANEDIOATE
    • Dimethyl 3-methylhexanedioate #
    • FT-0707143
    • SCHEMBL3309517
    • HOUQYONBQJFBPF-UHFFFAOYSA-N
    • 54576-13-5
    • G69123
    • DA-05006
    • MFCD18971226
    • Inchi： 1S/C9H16O4/c1-7(6-9(11)13-3)4-5-8(10)12-2/h7H,4-6H2,1-3H3
    • InChI Key： HOUQYONBQJFBPF-UHFFFAOYSA-N
    • SMILES： O(C)C(CC(C)CCC(=O)OC)=O

Computed Properties

  • Exact Mass: 188.10488
  • Monoisotopic Mass: 188.10485899g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 13
  • Rotatable Bond Count: 7
  • Complexity: 177
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 1
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 1
  • Topological Polar Surface Area: 52.6?2

Experimental Properties

  • PSA: 52.6

Hexanedioic acid, 3-methyl-, dimethyl ester Pricemore >>

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Hexanedioic acid, 3-methyl-, dimethyl ester Suppliers

Amadis Chemical Company Limited
Gold Member
Audited Supplier Audited Supplier
(CAS:54576-13-5)Hexanedioic acid, 3-methyl-, dimethyl ester
Order Number:A1223992
Stock Status:in Stock
Quantity:5g
Purity:99%
Pricing Information Last Updated:Friday, 30 August 2024 19:15
Price ($):475

Hexanedioic acid, 3-methyl-, dimethyl ester Related Literature

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Amadis Chemical Company Limited
(CAS:54576-13-5)Hexanedioic acid, 3-methyl-, dimethyl ester
A1223992
Purity:99%
Quantity:5g
Price ($):475
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