(2S,6R)-6-Amino-2-(2-thienyl)-1,4-thiazepan-5-one
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(2S,6R)-6-Amino-2-(2-thienyl)-1,4-thiazepan-5-one
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CAS No:
110221-26-6
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Formula:
C9H12N2OS2
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Chemical Name:
(2S,6R)-6-Amino-2-(2-thienyl)-1,4-thiazepan-5-one
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Synonyms:
(2S,6R)-6-AMINO-5-OXO-2-(2-THIENYL)PERHYDRO-1,4-THIAZEPINE;(2S, 6R)-6-amino-2-(2-thienyl)-1,4-thiazepan;(2S,6R)-6-amino-2-(2-thienyl)-1,4-thiazepin-5-oxo;(2S-trans)-6-Aminotetrahydro-2-(2-thienyl)-1,4-thiazepin-5(2H)-one;(2S,6R)-6-Amino-2-(2-thienyl)-1,4-thiazepan-5-one;1,4-Thiazepin-5(2H)-one, 6-aminotetrahydro-2-(2-thienyl)-, (2S,6R)-
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CAS No:
(2S,6R)-6-Amino-2-(2-thienyl)-1,4-thiazepan-5-one Basic Attributes
228.33
228.03910536
1312995-182-4
DTXSID00551264
Characteristics
108.66000
2.00860
white crystalline powder
1.286
163-1650C
492.8±45.0 °C(Predicted)
251.8ºC
1.604
7.46E-10mmHg at 25°C
14?+-.0.60
Computed Properties
Molecular Weight:228.3
XLogP3:0.3
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:1
Exact Mass:228.03910536
Monoisotopic Mass:228.03910536
Topological Polar Surface Area:109
Heavy Atom Count:14
Complexity:225
Defined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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