Cas no 73049-78-2 ((Isoquinolin-4-yl)methanol)

(Isoquinolin-4-yl)methanol structure
(Isoquinolin-4-yl)methanol structure
Product Name:(Isoquinolin-4-yl)methanol
CAS No:73049-78-2
MF:C10H9NO
MW:159.184562444687
CID:59419
Update Time:2023-08-02

(Isoquinolin-4-yl)methanol Chemical and Physical Properties

Names and Identifiers

    • Citronella grass oil
    • Citronella grass oil Cymbopogon nardus Rendle
    • Oil Of Citronella
    • citronella grass oil F. cymbopogon nard. rendle
    • Cymbopogon winterianus, ext.
    • Cymbopogon winterianus Jowitt
    • Java citronella
    • isoquinolin-4-ylmethanol
    • (isoquinolin-4-yl)methanol
    • 4-(hydroxymethyl)isoquinoline
    • 4-Isoquinolinemethanol
    • isoquinolin-4-yl-methanol
    • 4-HYDROXYMETHYLISOQUINOLINE
    • ZB1145
    • NE51001
    • Y9934
    • Citronellagrassoil
    • (Isoquinolin-4-yl)methanol
    • Inchi: 1S/C10H9NO/c12-7-9-6-11-5-8-3-1-2-4-10(8)9/h1-6,12H,7H2
    • InChI Key: QWTIYWBQFLATTN-UHFFFAOYSA-N
    • SMILES: OCC1C=NC=C2C=CC=CC=12

Computed Properties

  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 12
  • Rotatable Bond Count: 1
  • Complexity: 149
  • XLogP3: 1.2
  • Topological Polar Surface Area: 33.1

Experimental Properties

  • Density: 0.9
  • Boiling Point: 222 °C
  • Flash Point: 195 °F
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