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CAS Number: 35308-68-0
2-methyl-6,7-dihydro-1H-indol-4(5H)-one

Structure

2-methyl-6,7-dihydro-1H-indol-4(5H)-one
Name: 2-methyl-6,7-dihydro-1H-indol-4(5H)-one
Synonyms:
General Information
Product Number: 35308680

CAS Registry Number 35308-68-0
Name:
4H-?Indol-?4-?one, 1,?5,?6,?7-?tetrahydro-?2-?methyl-
Indol-4(5H)-one, 6,7-dihydro-2-methyl- (7CI)
1,5,6,7-Tetrahydro-2-methyl-4H-indol-4-one
2-Methyl-4,5,6,7-tetrahydroindol-4-one
2-Methyl-4-oxo-4,5,6,7-tetrahydroindole

 

Chemical Formula: C9H11NO
Exact Mass: 149.08
Molecular Weight: 149.19
m/z: 149.08 (100.0%), 150.09 (9.9%)

 

InChI:InChI=1S/C9H11NO/c1-6-5-7-8(10-6)3-2-4-9(7)11/h5,10H,2-4H2,1H3

InChI Key:HJIYEKHYUGHTAC-UHFFFAOYSA-N

Canonical SMILES:CC1=CC2=C(N1)CCCC2=O

 

Thermal Properties Value Condition Note
Melting Point 207-208 °C Solv: benzene (71-43-2) (4)IC
Melting Point 204-205 °C   (5)IC
Melting Point 204-205 °C   (2)ACD
Melting Point 204-205 °C   (6)IC
Melting Point 199-200 °C Solv: benzene (71-43-2) (7)IC
Melting Point 198-200 °C Solv: ethanol (64-17-5) (3)CAS

Specification

98%

References
  1. (2) Noguchi, Michihiko; Heterocycles 1989, V29(10), P2029-34 CAPLUS
  2. (3) Barraja, Paola; Bioorganic & Medicinal Chemistry 2008, V16(22), P9668-9683 CAPLUS
  3. (4) Berg-Nielsen, Karen; Acta Chemica Scandinavica, Series B: Organic Chemistry and Biochemistry 1978, VB32(8), P553-6 CAPLUS
  4. (5) LeTourneau, Michael E.; US 4745222 A 1988 CAPLUS
  5. (6) LeTourneau, Michael E.; US 4868315 A 1989 CAPLUS
  6. (7) Nitta, Makoto; Bulletin of the Chemical Society of Japan 1990, V63(3), P932-4 CAPLUS
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