Cas no 2085-15-6 (Propanedioic acid,butylethyl-)

Propanedioic acid,butylethyl- structure
Propanedioic acid,butylethyl- structure
Product Name:Propanedioic acid,butylethyl-
CAS No:2085-15-6
MF:C9H16O4
MW:188.220943450928
CID:284498
PubChem ID:23422958
Update Time:2025-04-19

Propanedioic acid,butylethyl- Chemical and Physical Properties

Names and Identifiers

    • Propanedioic acid,butylethyl-
    • 2-butyl-2-ethylpropanedioic acid
    • 2-BUTYL-2-ETHYLMALONIC ACID
    • Aethyl-butyl-malonsaeure
    • Butyl-ethyl-malonsaeure
    • ethyl-butyl-malonic acid
    • Ethyl-butyl-malonsaeure
    • Ethyl-n-butyl-malonsaeure
    • Propanedioic acid,butylethyl
    • Butyl(ethyl)propanedioic acid
    • Aethylbutylmalonsaure
    • 2-BUTYL-2-ETHYLMALONICACID
    • SCHEMBL1036461
    • DTXSID70633869
    • 2085-15-6
    • AKOS006285167
    • Inchi： 1S/C9H16O4/c1-3-5-6-9(4-2,7(10)11)8(12)13/h3-6H2,1-2H3,(H,10,11)(H,12,13)
    • InChI Key： MLEXVRSHDCOQPM-UHFFFAOYSA-N
    • SMILES： OC(C(C(=O)O)(CC)CCCC)=O

Computed Properties

  • Exact Mass: 188.10500
  • Monoisotopic Mass: 188.10485899g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 13
  • Rotatable Bond Count: 6
  • Complexity: 184
  • 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: 2.2
  • Topological Polar Surface Area: 74.6?2

Experimental Properties

  • PSA: 74.60000
  • LogP: 1.74220

Propanedioic acid,butylethyl- Customs Data

  • HS CODE：2917190090
  • Customs Data：

    China Customs Code:

    2917190090

    Overview:

    2917190090 Other acyclic polycarboxylic acids. 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, Terephthalic acid please specify4-CBAvalue, Terephthalic acid please specifyP-TLacid value, Terephthalic acid please indicate color, Terephthalic acid please indicate moisture

    Summary:

    2917190090 acyclic polycarboxylic acids, their anhydrides, halides, peroxides, peroxyacids and their derivatives VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:6.5% General tariff:30.0%

Propanedioic acid,butylethyl- Related Literature

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