中文版English

CAS Number: 66892-34-0
6-fluorochroman-4-one

Structure

6-fluorochroman-4-one
Name: 6-fluorochroman-4-one
Synonyms:
General Information
Product Number: 66892340
CAS Registry Number:
66892-34-0
Name:
4H-​1-​Benzopyran-​4-​one, 6-​fluoro-​2,​3-​dihydro-
6-​Fluoro-​2,​3-​dihydrochromen-​4-​one; 6-​Fluoro-​4-​chromanone; 6-​Fluorochromanone 
 
Chemical Formula: C9H7FO2
Exact Mass: 166.04
Molecular Weight: 166.15
m/z: 166.04 (100.0%), 167.05 (9.9%)
Elemental Analysis: C, 65.06; H, 4.25; F, 11.43; O, 19.26
 
InChI: InChI=1S/C9H7FO2/c10-6-1-2-9-7(5-6)8(11)3-4-12-9/h1-2,5H,3-4H2
InChIKey: SWBBIJZMIGAZHW-UHFFFAOYSA-N
Canonical SMILES : C1COC2=C(C1=O)C=C(C=C2)F
 
Thermal Properties Value Condition Note
Melting Point 114-116 °C Solv: ethanol (64-17-5) (2)IC
Melting Point 114 °C   (3)IC
Melting Point 113-116 °C   (4)IC
Melting Point 111-115 °C   (5)CAS
Melting Point 85 °C (sublm) Press: 1.1 Torr (4)IC

Specification

98%

References

  • (2) Hu, Shuigen; Yiyao Gongye 1988, V19(1), P31-2 CAPLUS
  • (3) Wirth, Didier; FR 2588860 A1 1987 CAPLUS
  • (4) Sarges, Reinhard; Journal of Medicinal Chemistry 1985, V28(11), P1716-20 CAPLUS
  • (5) Hasegawa, Ryoichi; JP 62267282 A 1987 CAPLUS
  • (6) Moore, Bernard S.; US 4551542 A 1985 CAPLUS
  • Contact Us
    TEL:  86-17758012822
    FAX:  86-571-87759731
    E-mail:sales@hzchempro.com
    [ CLOSE ]