CAS Number: 57543-66-5
2H-chromene-3-carbonitrile
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Structure |
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| Name: 2H-chromene-3-carbonitrile |
| Synonyms: |
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| General Information |
Product Number: 57543665
CAS Registry Number 57543-66-5
Name:
2H-?1-?Benzopyran-?3-?carbonitrile
3-Chromenecarbonitrile
3-Cyanochromene
NSC 279236
Chemical Formula: C10H7NO
Exact Mass: 157.05
Molecular Weight: 157.17
m/z: 157.05 (100.0%), 158.06 (10.9%)
InChI:InChI=1S/C10H7NO/c11-6-8-5-9-3-1-2-4-10(9)12-7-8/h1-5H,7H2
InChI Key:NQOLOKKZYCSJRL-UHFFFAOYSA-N
Canonical SMILES:C1C(=CC2=CC=CC=C2O1)C#N
| Thermal Properties |
Value |
Condition |
Note |
| Melting Point |
53 °C |
|
(3)CAS |
| Melting Point |
50 °C |
|
(4)CAS |
| Melting Point |
48-49 °C |
|
(5)CAS |
| Melting Point |
48-49 °C |
|
(6)IC |
| Melting Point |
48-49 °C |
Solv: ethanol (64-17-5) |
(7)IC |
| Melting Point |
47-48 °C |
|
(2)IC |
| Melting Point |
47 °C |
Solv: water (7732-18-5); ethanol (64-17-5) |
(8)IC |
| Melting Point |
44-45 °C |
|
(1)CAS |
|
Specification |
98%
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| References |
- (1) Tsai, Jui-Chi; Journal of Organic Chemistry 2009, V74(22), P8798-8801 CAPLUS
- (2) Mouysset, Genevieve; European Journal of Medicinal Chemistry 1987, V22(6), P539-44 CAPLUS
- (3) Meenakshi, C.; International Journal of Chemical Sciences 2006, V4(1), P125-126 CAPLUS
- (4) Taylor, Helan V.; Journal of the Chemical Society 1950, P2724-5 CAPLUS
- (5) Bachman, G. Bryant; Journal of the American Chemical Society 1948, V70, P599-601 CAPLUS
- (6) Tanaka, Mamoru; Chemical & Pharmaceutical Bulletin 1978, V26(5), P1558-69 CAPLUS
- (7) Shimizu, Tomio; Bulletin of the Chemical Society of Japan 1981, V54(1), P217-22 CAPLUS
- (8) Gupta, R. C.; Indian Journal of Chemistry, Section B: Organic Chemistry Including Medicinal Chemistry 1982, V21B(4), P344-7 CAPLUS
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