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CAS Number: 51925-41-8
2-mercaptoquinoline-3-carbaldehyde

Structure

2-mercaptoquinoline-3-carbaldehyde
Name: 2-mercaptoquinoline-3-carbaldehyde
Synonyms:
General Information
Product Number: 51925418

CAS Registry Number 51925-41-8
Name:
3-​Quinolinecarboxaldeh​yde, 1,​2-​dihydro-​2-​thioxo-
3-Formyl-2-mercaptoquinoline
3-Formylquinoline-2(1H)-thione

 

Chemical Formula: C10H7NOS
Exact Mass: 189.02
Molecular Weight: 189.23
m/z: 189.02 (100.0%), 190.03 (10.9%), 191.02 (4.5%), 190.02 (1.2%)

 

InChI:InChI=1S/C10H7NOS/c12-6-8-5-7-3-1-2-4-9(7)11-10(8)13/h1-6H,(H,11,13)

InChI Key:QGNIZTZEZZJHEK-UHFFFAOYSA-N

Canonical SMILES:C1=CC=C2C(=C1)C=C(C(=S)N2)C=O

 

Thermal Properties Value Condition Note
Melting Point 286 °C (decomp)   (5)IC
Melting Point 245 °C   (6)CAS
Melting Point >193 °C Solv: ethyl acetate (141-78-6); benzene (71-43-2) (2)CAS
Melting Point 160 °C   (3)CAS
Melting Point See full text   (4)CAS

Specification

98%

References
  1. (2) Nandeshwarappa, Belalakatte P.; Phosphorus, Sulfur and Silicon and the Related Elements 2006, V181(9), P1997-2003 CAPLUS
  2. (3) Prakash Naik, H. R.; Phosphorus, Sulfur and Silicon and the Related Elements 2009, V184(2), P460-470 CAPLUS
  3. (4) Srivastava, Ambika; Indian Journal of Chemistry, Section B: Organic Chemistry Including Medicinal Chemistry 2005, V44B(9), P1868-1875 CAPLUS
  4. (5) Meth-Cohn, Otto; Journal of the Chemical Society, Perkin Transactions 1: Organic and Bio-Organic Chemistry (1972-1999) 1981, (9), P2509-17 CAPLUS
  5. (6) Narayanachar; Journal of Chemical and Pharmaceutical Research 2011, V3(4), P504-517 CAPLUS
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