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Methyl 5-(2-methylthiazol-4-yl)thiophene-2-carboxylate

HCID 2819954
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Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
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Basic information

Standard SMILES
COC(=O)c1ccc(-c2csc(C)n2)s1
InChIKey
LKUXKRSTNNZJAV-UHFFFAOYSA-N
Molecular formula
C10H9NO2S2
Average molar mass
239.3 g/mol

Names & identifiers

Preferred name
Methyl 5-(2-methylthiazol-4-yl)thiophene-2-carboxylate
IUPAC
methyl 5-(2-methyl-1,3-thiazol-4-yl)thiophene-2-carboxylate

Names & synonyms

Maybridge3_003713SCHEMBL6497659methyl 5-(2-methylthiazol-4-yl)thiophene-2-carboxylateLKUXKRSTNNZJAV-UHFFFAOYSA-NHMS1441I17IDI1_015100methyl 5-(2-methylthiazolyl)-thiophene-2-carboxylatemethyl 5-(2-methylthiazol-4-yl)-thiophene-2-carboxylatemethyl 5-(2-methylthiazol4-yl)-thiophene-2-carboxylate

Database identifiers

PubChem CID
2819954

Properties

Computed structural properties

XLogP
2.9
Topological polar surface area
95.7 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
5
Rotatable bonds
3
Heavy atoms
15
Formal charge
0
Complexity
250

Related reactions

5 records
New reaction record
HRID 97985 reaction equation
HRID 97985As reactantTraining data from https://doi.org/10.1039/C8SC04228D (2/10)
HRID 896463 reaction equation
HRID 896463As reactantuspto-grants-2005_07
HRID 1359632 reaction equation
HRID 1359632As reactantuspto-grants-2003_07
HRID 2298351 reaction equation
HRID 2298351As reactantuspto-grants-2002_12
HRID 2301859 reaction equation
HRID 2301859As reactantuspto-grants-2002_12

Compound notes

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