Cas no 55812-46-9 (1,2-Ethanediol,1-[3-(hydroxymethyl)-9H-pyrido[3,4-b]indol-1-yl]-, (1R)-)

1,2-Ethanediol,1-[3-(hydroxymethyl)-9H-pyrido[3,4-b]indol-1-yl]-, (1R)- structure
55812-46-9 structure
Product Name:1,2-Ethanediol,1-[3-(hydroxymethyl)-9H-pyrido[3,4-b]indol-1-yl]-, (1R)-
CAS No:55812-46-9
MF:C14H14N2O3
MW:258.272563457489
CID:372081
PubChem ID:5358591
Update Time:2025-04-19

1,2-Ethanediol,1-[3-(hydroxymethyl)-9H-pyrido[3,4-b]indol-1-yl]-, (1R)- Chemical and Physical Properties

Names and Identifiers

    • 1,2-Ethanediol,1-[3-(hydroxymethyl)-9H-pyrido[3,4-b]indol-1-yl]-, (1R)-
    • 1-[3-(hydroxymethyl)-9H-pyrido[3,4-b]indol-1-yl]ethane-1,2-diol
    • Pyridindolol
    • (R)-(-)-pyridindolol
    • Antibiotic TUE 2480(sub 1)
    • K 251 SB
    • NCI60_002145
    • NSC 266530
    • NSC266530
    • 55812-46-9
    • NSC-266530
    • 1-(1(R),2-dihydroxyethyl)-3-hydroxymethyl-9H-pyrido(3,4-b)indole
    • MEGxm0_000366
    • BRN 0620835
    • 5-23-13-00550 (Beilstein Handbook Reference)
    • ACon1_000538
    • (R)-alpha(sup 1)-(Hydroxymethyl)-9H-pyrido(3,4-b)indole-1,3-dimethanol
    • CHEMBL1965306
    • BRD-A39915172-001-01-1
    • 9H-Pyrido(3,4-b)indole-1,3-dimethanol, alpha(sup 1)-(hydroxymethyl)-, (R)-
    • Antibiotic Tue 2480F1
    • K 251sb
    • Inchi: 1S/C14H14N2O3/c17-6-8-5-10-9-3-1-2-4-11(9)16-13(10)14(15-8)12(19)7-18/h1-5,12,16-19H,6-7H2
    • InChI Key: VAKXHGQDPLEUTH-UHFFFAOYSA-N
    • SMILES: OC(CO)C1C2=C(C=C(CO)N=1)C1C=CC=CC=1N2

Computed Properties

  • Exact Mass: 258.10000
  • Monoisotopic Mass: 258.1
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 4
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 19
  • Rotatable Bond Count: 3
  • Complexity: 315
  • 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
  • Topological Polar Surface Area: 89.4A^2
  • XLogP3: 0

Experimental Properties

  • Density: 1.505
  • Boiling Point: 604.3°Cat760mmHg
  • Flash Point: 319.3°C
  • Refractive Index: 1.802
  • PSA: 89.37000
  • LogP: 1.23410

1,2-Ethanediol,1-[3-(hydroxymethyl)-9H-pyrido[3,4-b]indol-1-yl]-, (1R)- Customs Data

  • HS CODE:2933990090
  • Customs Data:

    China Customs Code:

    2933990090

    Overview:

    2933990090. Other heterocyclic compounds containing only nitrogen heteroatoms. VAT:17.0%. Tax refund rate:13.0%. Regulatory conditions:nothing. MFN tariff:6.5%. general tariff:20.0%

    Declaration elements:

    Product Name, component content, use to, Please indicate the appearance of Urotropine, 6- caprolactam please indicate the appearance, Signing date

    Summary:

    2933990090. heterocyclic compounds with nitrogen hetero-atom(s) only. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

1,2-Ethanediol,1-[3-(hydroxymethyl)-9H-pyrido[3,4-b]indol-1-yl]-, (1R)- Pricemore >>

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