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Ethyl 2-methyl-5-[(1S,2R,3R)-1,2,3,4-tetrahydroxybutyl]-3-furancarboxylate

Ethyl 2-methyl-5-[(1S,2R,3R)-1,2,3,4-tetrahydroxybutyl]-3-furancarboxylate structure

CAS No:
3351-43-7
Formula:
C12H18O7
Chemical Name:
Ethyl 2-methyl-5-[(1S,2R,3R)-1,2,3,4-tetrahydroxybutyl]-3-furancarboxylate
Synonyms:
3-Furancarboxylic acid,2-methyl-5-[(1S,2R,3R)-1,2,3,4-tetrahydroxybutyl]-,ethyl ester;3-Furoic acid,2-methyl-5-(D-arabino-1,2,3,4-tetrahydroxybutyl)-,ethyl ester;3-Furancarboxylic acid,2-methyl-5-(D-arabino-1,2,3,4-tetrahydroxybutyl)-,ethyl ester;3-Furoic acid,2-methyl-5-(D-arabino-tetrahydroxybutyl)-,ethyl ester;Ethyl 2-methyl-5-[(1S,2R,3R)-1,2,3,4-tetrahydroxybutyl]-3-furancarboxylate;Glucose cyclo-acetoacetate;Ethyl 2-methyl-5-(D-arabino-1,2,3,4-tetrahydroxybutyl)-3-furoate;802007-78-9

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Ethyl 2-methyl-5-[(1S,2R,3R)-1,2,3,4-tetrahydroxybutyl]-3-furancarboxylate Basic Attributes

Molecular Weight：

274.27 g/mol

Exact Mass：

274.27

NSC Number：

61091|52471|5569

Characteristics

PSA：

120 Å²

Melting Point：

147 °C

Drug Information

MeSH Entry Terms：

5-(arabino-tetrahydroxybutyl)-2-methyl-3-furoic acid

Computed Properties

Molecular Weight:274.27
XLogP3:-1.1
Hydrogen Bond Donor Count:4
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:7
Exact Mass:274.10525291
Monoisotopic Mass:274.10525291
Topological Polar Surface Area:120
Heavy Atom Count:19
Complexity:296
Undefined Atom Stereocenter Count:3
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of Ethyl 2-methyl-5-[(1S,2R,3R)-1,2,3,4-tetrahydroxybutyl]-3-furancarboxylate

Basic Attributes
Characteristics
Drug Information
Computed Properties
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