4-Diethylamino-2-butynyl phenyl(2-thienyl)glycolate hydrochloride

Modify Date: 2024-01-10 20:30:52

4-Diethylamino-2-butynyl phenyl(2-thienyl)glycolate hydrochloride Structure
4-Diethylamino-2-butynyl phenyl(2-thienyl)glycolate hydrochloride structure
 Common Name 4-Diethylamino-2-butynyl phenyl(2-thienyl)glycolate hydrochloride
CAS Number 3512-32-1 Molecular Weight 393.92700
Density 1.194g/cm3 Boiling Point 511.6ºC at 760 mmHg
Molecular Formula C20H24ClNO3S Melting Point N/A
MSDS N/A Flash Point 263.2ºC

 Names

Name 4-(diethylamino)but-2-ynyl 2-hydroxy-2-phenyl-2-thiophen-2-ylacetate,hydrochloride
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.194g/cm3
Boiling Point 511.6ºC at 760 mmHg
Molecular Formula C20H24ClNO3S
Molecular Weight 393.92700
Flash Point 263.2ºC
Exact Mass 393.11700
PSA 78.01000
LogP 3.67440
Index of Refraction 1.584
InChIKey RXVAOSKEPZWZSF-UHFFFAOYSA-N
SMILES CCN(CC)CC#CCOC(=O)C(O)(c1ccccc1)c1cccs1.Cl

 Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
XM9386000
CHEMICAL NAME :
2-Thiopheneglycolic acid, alpha-phenyl-, 4-(diethylamino)-2-butynyl ester, hydrochloride
CAS REGISTRY NUMBER :
3512-32-1
LAST UPDATED :
199012
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C20-H23-N-O3-S.Cl-H
MOLECULAR WEIGHT :
393.96
WISWESSER LINE NOTATION :
T5SJ BXQR&VO2UU2N2&2 &GH

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intravenous
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
56 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#11089

 Synonyms

4-(diethylamino)but-2-ynyl 2-hydroxy-2-phenyl-2-thiophen-2-ylacetate hydrochloride
4-Diethylamino-2-butynyl phenyl(2-thienyl)glycolate hydrochloride
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Chemsrc provides CAS#:3512-32-1 MSDS, density, melting point, boiling point, structure, etc. Its name is 4-Diethylamino-2-butynyl phenyl(2-thienyl)glycolate hydrochloride>> amp version: 4-Diethylamino-2-butynyl phenyl(2-thienyl)glycolate hydrochloride

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