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Ethyl (3aS,4S,6aR)-hexahydro-2-oxo-1H-thieno[3,4-d]imidazole-4-pentanoate

Ethyl (3aS,4S,6aR)-hexahydro-2-oxo-1H-thieno[3,4-d]imidazole-4-pentanoate structure

CAS No:
87573-52-2
Formula:
C12H20N2O3S
Chemical Name:
Ethyl (3aS,4S,6aR)-hexahydro-2-oxo-1H-thieno[3,4-d]imidazole-4-pentanoate
Synonyms:
1H-Thieno[3,4-d]imidazole-4-pentanoic acid,hexahydro-2-oxo-,ethyl ester,(3aS,4S,6aR)-;1H-Thieno[3,4-d]imidazole-4-pentanoic acid,hexahydro-2-oxo-,ethyl ester,[3aS-(3aα,4β,6aα)]-;Ethyl (3aS,4S,6aR)-hexahydro-2-oxo-1H-thieno[3,4-d]imidazole-4-pentanoate

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Ethyl (3aS,4S,6aR)-hexahydro-2-oxo-1H-thieno[3,4-d]imidazole-4-pentanoate Basic Attributes

Molecular Weight：

272.3638

Exact Mass：

272.36

EC Number：

289-323-8

DSSTox ID：

DTXSID60236469

Characteristics

PSA：

92.7

XLogP3：

Melting Point：

80-81 °C

Computed Properties

Molecular Weight:272.37
XLogP3:1
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:7
Exact Mass:272.11946368
Monoisotopic Mass:272.11946368
Topological Polar Surface Area:92.7
Heavy Atom Count:18
Complexity:324
Defined Atom Stereocenter Count:3
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of Ethyl (3aS,4S,6aR)-hexahydro-2-oxo-1H-thieno[3,4-d]imidazole-4-pentanoate

Basic Attributes
Characteristics
Computed Properties
Learn More Other Chemicals

Ethyl (3aS,4S,6aR)-hexahydro-2-oxo-1H-thieno[3,4-d]imidazole-4-pentanoate

SDS

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