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CAS Number: 7182-21-0
3-methylbenzofuran-5-ol

Structure

3-methylbenzofuran-5-ol
Name: 3-methylbenzofuran-5-ol
Synonyms:
General Information
Product Number: 7182210
CAS Number:
7182-21-0
Name:
5-Benzofuranol,3-methyl-
Synonyms:
3-Methyl-5-benzofuranol;3-Methyl-5-hydroxybenzofuran;5-Hydroxy-3-methylbenzofuran;
Chemical Formula: C9H8O2
Exact Mass: 148.05
Molecular Weight: 148.16
m/z: 148.05 (100.0%), 149.06 (9.9%)
Elemental Analysis: C, 72.96; H, 5.44; O, 21.60
InChI: InChI=1S/C9H8O2/c1-6-5-11-9-3-2-7(10)4-8(6)9/h2-5,10H,1H3
InChIKey: CFWUXOWTWHWMSB-UHFFFAOYSA-N
Canonical SMILES : CC1=COC2=C1C=C(C=C2)O
 
 
Thermal Properties Value Condition Note
Melting Point 93-94 °C   (3)IC
Melting Point 92 °C   (4)CAS
Melting Point 92 °C   (5)CAS
Melting Point 90 °C Solv: ethanol (64-17-5); water (7732-18-5) (2)IC
Melting Point 84-85 °C   (6)IC

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) Birkofer, Leonhard; Chemische Berichte 1986, V119(1), P257-78 CAPLUS
  3. (3) Lee, Junning; Journal of Organic Chemistry 1990, V55(17), P4995-5008 CAPLUS
  4. (4) Domschke, Guenter; Journal fuer Praktische Chemie (Leipzig) 1966, V32(3-4), P144-57 CAPLUS
  5. (5) Whalley, W. B.; Journal of the Chemical Society 1953, P3479-83 CAPLUS
  6. (6) Belanger, Patrice C.; EP 165810 A2 1985 CAPLUS
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