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2-(Allyl-methyl-amino)-thiazol-4-one (HCID 14548302)|Huagongshe
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Compound
2-(Allyl-methyl-amino)-thiazol-4-one
HCID
14548302
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Reactions
Basic information
Names & identifiers
Properties
Related reactions
Compound notes
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Basic information
Standard SMILES
C=CCN(C)C1=NC(=O)CS1
InChIKey
FUMQUKINKJQRMY-UHFFFAOYSA-N
Molecular formula
C7H10N2OS
Average molar mass
170.23 g/mol
Names & identifiers
Preferred name
2-(Allyl-methyl-amino)-thiazol-4-one
IUPAC
2-[methyl(prop-2-enyl)amino]-1,3-thiazol-4-one
Names & synonyms
SCHEMBL2278212
FUMQUKINKJQRMY-UHFFFAOYSA-N
2-(allyl-methyl-amino)-thiazol-4-one
Database identifiers
PubChem CID
14548302
Properties
Computed structural properties
XLogP
1
Topological polar surface area
58 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
2
Rotatable bonds
3
Heavy atoms
11
Formal charge
0
Complexity
212
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Related reactions
3 records
New reaction record
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As reactant
As product
As reagent
As catalyst
As solvent
HRID
1213274
As reactant
Training data from https://doi.org/10.1039/C8SC04228D (5/10)
HRID
1970157
As product
uspto-grants-2013_04
HRID
1970158
As reactant
uspto-grants-2013_04
Compound notes
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