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CAS Number: 59743-88-3
10-methoxy-4-(1-methylpiperidin-4-yl)-4H-benzo[4,5]cyclohepta[1,2-b]thiophen-4-ol

Structure

 10-methoxy-4-(1-methylpiperidin-4-yl)-4H-benzo[4,5]cyclohepta[1,2-b]thiophen-4-ol
Name: 10-methoxy-4-(1-methylpiperidin-4-yl)-4H-benzo[4,5]cyclohepta[1,2-b]thiophen-4-ol
Synonyms:
General Information
Product Number: 59743883

CAS Registry Number 59743-88-3
Name:
4H-?Benzo[4,?5]?cyclohepta[1,?2-?b]?thiophene-?4-?ol, 10-?methoxy-?4-?(1-?methyl-?4-?piperidinyl)?-
4H-Benzo[4,5]cyclohepta[1,2]thiophene-4-ol, 10-methoxy-4-(1-methyl-4-piperidinyl)- (9CI)

 

Chemical Formula: C20H23NO2S
Exact Mass: 341.14
Molecular Weight: 341.47
m/z: 341.14 (100.0%), 342.15 (22.0%), 343.14 (4.5%), 343.15 (3.0%), 342.14 (1.2%)

 

InChI:InChI=1S/C20H23NO2S/c1-21-10-7-15(8-11-21)20(22)16-6-4-3-5-14(16)13-18(23-2)19-17(20)9-12-24-19/h3-6,9,12-13,15,22H,7-8,10-11H2,1-2H3

InChI Key:AAYKXJAFSKIHRK-UHFFFAOYSA-N

Canonical SMILES:CN1CCC(CC1)C2(C3=C(C(=CC4=CC=CC=C42)OC)SC=C3)O

 

Thermal Properties Value Condition Note
Melting Point 194-196 °C Solv: ethanol (64-17-5) (2)IC
Melting Point See full text   (1)IC

Specification

98%
References
  1. (1) Polivka, Zdenek; Collection of Czechoslovak Chemical Communications 1989, V54(9), P2443-69 CAPLUS
  2. (2) Waldvogel, Erwin; Helvetica Chimica Acta 1976, V59(3), P866-77 CAPLUS
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