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CAS Number: 1074-85-7
(1H-indol-4-yl)methanol

Structure

(1H-indol-4-yl)methanol
Name: (1H-indol-4-yl)methanol
Synonyms:
General Information
Product Number: 1074857
CAS Registry Number: 1074-85-7
Name:
1H-​Indole-​4-​methanol
Indole-​4-​methanol (7CI,​8CI); (1H-​Indol-​4-​yl)​methanol 
 
Chemical Formula: C9H9NO
Exact Mass: 147.07
Molecular Weight: 147.17
m/z: 147.07 (100.0%), 148.07 (10.2%)
Elemental Analysis: C, 73.45; H, 6.16; N, 9.52; O, 10.87
 
InChI: InChI=1S/C9H9NO/c11-6-7-2-1-3-9-8(7)4-5-10-9/h1-5,10-11H,6H2
InChIKey: BVSGXWCTWBZFEV-UHFFFAOYSA-N
Canonical SMILES : C1=CC(=C2C=CNC2=C1)CO
 
Thermal Properties Value Condition Note
Melting Point 67-68 °C   (2)IC
Melting Point 59-61 °C   (4)CAS
Melting Point 56.5-57.5 °C   (5)IC
Melting Point 56.0-57.5 °C   (6)IC
Melting Point 56-57 °C   (7)CAS

Specification

98%

References
  1. (1) BIORAD: Infrared spectral data from the Bio-Rad/Sadtler IR Data Collection was obtained from Bio-Rad Laboratories, Philadelphia, PA (US). Copyright © Bio-Rad Laboratories. All Rights Reserved.
  2. (2) Cannon, Joseph G.; Journal of Heterocyclic Chemistry 1982, V19(5), P1195-9 CAPLUS
  3. (3) Antoine, Maud; Journal of Enzyme Inhibition and Medicinal Chemistry 2008, V23(5), P686-695 CAPLUS
  4. (4) Hofmann, Albert; FR 1373316 1964 CAPLUS
  5. (5) Somei, Masanori; Heterocycles 1982, V17(Spec. Issue), P417-23 CAPLUS
  6. (6) Somei, Masanori; Chemistry Letters 1980, (7), P813-16 CAPLUS
  7. (7) Hardegger, E.; Helvetica Chimica Acta 1954, V37, P1826-7 CAPLUS
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