diethyl 4-(2-furyl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate

Modify Date: 2024-01-10 00:49:44

diethyl 4-(2-furyl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate Structure
diethyl 4-(2-furyl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate structure
Common Name diethyl 4-(2-furyl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate
CAS Number 23118-56-1 Molecular Weight 319.35200
Density 1.156g/cm3 Boiling Point 429.9ºC at 760mmHg
Molecular Formula C17H21NO5 Melting Point N/A
MSDS N/A Flash Point 213.8ºC

 Names

Name diethyl 4-(furan-2-yl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.156g/cm3
Boiling Point 429.9ºC at 760mmHg
Molecular Formula C17H21NO5
Molecular Weight 319.35200
Flash Point 213.8ºC
Exact Mass 319.14200
PSA 77.77000
LogP 2.96940
Vapour Pressure 1.35E-07mmHg at 25°C
Index of Refraction 1.512

 Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
US7978000
CHEMICAL NAME :
3,5-Pyridinedicarboxylic acid, 1,4-dihydro-4-(2-furyl)-2,6-dimethyl-, diethyl ester
CAS REGISTRY NUMBER :
23118-56-1
BEILSTEIN REFERENCE NO. :
0288948
LAST UPDATED :
199612
DATA ITEMS CITED :
2
MOLECULAR FORMULA :
C17-H21-N-O5
MOLECULAR WEIGHT :
319.39
WISWESSER LINE NOTATION :
T6M DHJ B1 CVO2 EVO2 F1 D- BT5OJ

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
>7500 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
PCJOAU Pharmaceutical Chemistry Journal (English Translation). Translation of KHFZAN. (Plenum Pub. Corp., 233 Spring St., New York, NY 10013) No.1- 1967- Volume(issue)/page/year: 13,611,1979
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intravenous
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
180 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
CSLNX* U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. (Aberdeen Proving Ground, MD 21010) Volume(issue)/page/year: NX#01322

 Safety Information

HS Code 2934999090

 Synthetic Route

~98%

diethyl 4-(2-furyl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate Structure

diethyl 4-(2-fu...

CAS#:23118-56-1

Literature: Baghbanian, Seyed Meysam; Khaksar, Samad; Vahdat, Seyed Mohammad; Farhang, Maryam; Tajbakhsh, Mahmood Chinese Chemical Letters, 2010 , vol. 21, # 5 p. 563 - 567

~61%

Detail
Literature: Angeles-Beltran, Deyanira; Lomas-Romero, Leticia; Lara-Corona, Victor H.; Gonzalez-Zamora, Eduardo; Negron-Silva, Guillermo Molecules, 2006 , vol. 11, # 10 p. 731 - 738

~87%

diethyl 4-(2-furyl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate Structure

diethyl 4-(2-fu...

CAS#:23118-56-1

Literature: Yadav; Subba Reddy; Reddy Synthetic Communications, 2001 , vol. 31, # 3 p. 425 - 430

~37%

diethyl 4-(2-furyl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate Structure

diethyl 4-(2-fu...

CAS#:23118-56-1

Detail
Literature: Ilavsky, Dusan; Milata, Viktor Collection of Czechoslovak Chemical Communications, 1996 , vol. 61, # 8 p. 1233 - 1243

~37%

diethyl 4-(2-furyl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate Structure

diethyl 4-(2-fu...

CAS#:23118-56-1

Detail
Literature: Ilavsky, Dusan; Milata, Viktor Collection of Czechoslovak Chemical Communications, 1996 , vol. 61, # 8 p. 1233 - 1243

~34%

diethyl 4-(2-furyl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate Structure

diethyl 4-(2-fu...

CAS#:23118-56-1

Detail
Literature: Ilavsky, Dusan; Milata, Viktor Collection of Czechoslovak Chemical Communications, 1996 , vol. 61, # 8 p. 1233 - 1243

~%

diethyl 4-(2-furyl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate Structure

diethyl 4-(2-fu...

CAS#:23118-56-1

Literature: Vanden Eynde; D'Orazio; Mayence; Maquestiau; Anders Tetrahedron, 1992 , vol. 48, # 7 p. 1263 - 1268

~%

diethyl 4-(2-furyl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate Structure

diethyl 4-(2-fu...

CAS#:23118-56-1

Literature: Kastron,V.V. et al. Pharmaceutical Chemistry Journal, 1979 , vol. 13, # 6 p. 611 - 616 Khimiko-Farmatsevticheskii Zhurnal, 1979 , vol. 13, # 6 p. 57 - 62

~%

diethyl 4-(2-furyl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate Structure

diethyl 4-(2-fu...

CAS#:23118-56-1

Literature: Vanden Eynde; D'Orazio; Mayence; Maquestiau; Anders Tetrahedron, 1992 , vol. 48, # 7 p. 1263 - 1268

 Customs

HS Code 2934999090
Summary 2934999090. other heterocyclic compounds. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

 Synonyms

4-fluorophenyl methyl sulfide
4-fluoro-1-methylthiobenzene
4-F-phenyl methyl sulfide
1-fluoro-4-methylsulfanyl-benzene
4-Fluorothioanisole
4-furan-2-yl-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylicacid diethyl ester
p-fluorophenyl methyl sulfide
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