Cas no 22272-21-5 (1,4-Naphthalenedione,2-chloro-3-(hexadecylamino)-)

1,4-Naphthalenedione,2-chloro-3-(hexadecylamino)- structure
22272-21-5 structure
Product Name:1,4-Naphthalenedione,2-chloro-3-(hexadecylamino)-
CAS No:22272-21-5
MF:C26H38ClNO2
MW:432.038426876068
CID:271652
PubChem ID:236658
Update Time:2025-04-19

1,4-Naphthalenedione,2-chloro-3-(hexadecylamino)- Chemical and Physical Properties

Names and Identifiers

    • 1,4-Naphthalenedione,2-chloro-3-(hexadecylamino)-
    • 2-chloro-3-(hexadecylamino)naphthalene-1,4-dione
    • 3-Hexadecylamino-2-chlor-1,4-naphthochinon
    • DTXSID50284858
    • A817828
    • 2-chloranyl-3-(hexadecylamino)naphthalene-1,4-dione
    • 22272-21-5
    • NSC-39354
    • NSC39354
    • Inchi： 1S/C26H38ClNO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-17-20-28-24-23(27)25(29)21-18-15-16-19-22(21)26(24)30/h15-16,18-19,28H,2-14,17,20H2,1H3
    • InChI Key： MIOOSJHVLGHSBL-UHFFFAOYSA-N
    • SMILES： ClC1C(C2C=CC=CC=2C(C=1NCCCCCCCCCCCCCCCC)=O)=O

Computed Properties

  • Exact Mass: 431.25900
  • Monoisotopic Mass: 431.259107
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 30
  • Rotatable Bond Count: 16
  • Complexity: 557
  • 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
  • Topological Polar Surface Area: 46.2
  • XLogP3: 10.2

Experimental Properties

  • Density: 1.07
  • Boiling Point: 520.2°Cat760mmHg
  • Flash Point: 268.4°C
  • Refractive Index: 1.535
  • PSA: 46.17000
  • LogP: 7.97780

1,4-Naphthalenedione,2-chloro-3-(hexadecylamino)- Customs Data

  • HS CODE：2922399090
  • Customs Data：

    China Customs Code:

    2922399090

    Overview:

    2922399090 Other amino aldehydes\Amino ketones and their salts(Including aminoquinone and its salts,Except those containing more than one oxygen-containing group). 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, The color of ethanolamine and its salt should be reported, The package of ethanolamine and its salt shall be declared

    Summary:

    2922399090 other amino-aldehydes, amino-ketones and amino-quinones, other than those containing more than one kind of oxygen function; salts thereof VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:6.5% General tariff:30.0%

1,4-Naphthalenedione,2-chloro-3-(hexadecylamino)- Related Literature

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