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1-[3-AMINO-6-(2-THIENYL)-4-(TRIFLUOROMETHYL)THIENO[2,3-B]PYRIDIN-2-YL]ETHAN-1-ONE

1-[3-AMINO-6-(2-THIENYL)-4-(TRIFLUOROMETHYL)THIENO[2,3-B]PYRIDIN-2-YL]ETHAN-1-ONE structure

CAS No:
285980-95-2
Formula:
C14H9F3N2OS2
Chemical Name:
1-[3-AMINO-6-(2-THIENYL)-4-(TRIFLUOROMETHYL)THIENO[2,3-B]PYRIDIN-2-YL]ETHAN-1-ONE
Synonyms:
1-[3-amino-6-(2-thienyl)-4-(trifluoromethyl)thieno[2,3-b]pyridin-2-yl]ethan-1-one;MLS000080359;SMR000037404;1-[3-amino-6-(thiophen-2-yl)-4-(trifluoromethyl)thieno[2,3-b]pyridin-2-yl]ethanone;1-(3-Amino-6-(thiophen-2-yl)-4-(trifluoromethyl)thieno[2,3-b]pyridin-2-yl)ethanone;1-[3-amino-6-(2-thienyl)-4-(trifluoromethyl)thieno[2,3-b]pyridin-2-yl]ethanone;regid860525;Maybridge1_005981;cid_661810;CHEMBL1423165

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1-[3-AMINO-6-(2-THIENYL)-4-(TRIFLUOROMETHYL)THIENO[2,3-B]PYRIDIN-2-YL]ETHAN-1-ONE Basic Attributes

Molecular Weight：

342.36

Exact Mass：

342.01100

DSSTox ID：

DTXSID50349794

HScode：

2934999090

Characteristics

PSA：

113

XLogP3：

5.40960

Density：

1.499g/cm3

Melting Point：

171 °C

Boiling Point：

508.7ºC at 760 mmHg

Flash Point：

261.5ºC

Refractive Index：

1.645

Vapor Pressure：

1.81E-10mmHg at 25°C

Safety Information

Precautionary statement(s)：

P264, P270, P280, P301+P310, P305+P351+P338, P321, P330, P337+P313, P405, P501

Hazard Statements：

H301

GHS Classification：

|Danger|H301 (100%): Toxic if swallowed [Danger Acute toxicity, oral]|P264, P270, P280, P301+P310, P305+P351+P338, P321, P330, P337+P313, P405, and P501|Aggregated GHS information provided by 38 companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Computed Properties

Molecular Weight:342.4
XLogP3:4.4
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:2
Exact Mass:342.01083975
Monoisotopic Mass:342.01083975
Topological Polar Surface Area:113
Heavy Atom Count:22
Complexity:448
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 1-[3-AMINO-6-(2-THIENYL)-4-(TRIFLUOROMETHYL)THIENO[2,3-B]PYRIDIN-2-YL]ETHAN-1-ONE

Basic Attributes
Characteristics
Safety Information
Computed Properties

1-[3-AMINO-6-(2-THIENYL)-4-(TRIFLUOROMETHYL)THIENO[2,3-B]PYRIDIN-2-YL]ETHAN-1-ONE

SDS

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