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N-[(2-chloroacetyl)carbamoyl]prop-2-enamide (HCID 23451636)|Huagongshe
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Compound
N-[(2-chloroacetyl)carbamoyl]prop-2-enamide
HCID
23451636
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Compound notes
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Basic information
Standard SMILES
C=CC(=O)NC(=O)NC(=O)CCl
InChIKey
AVHANCRMIXVFTD-UHFFFAOYSA-N
Molecular formula
C6H7ClN2O3
Average molar mass
190.58 g/mol
Names & identifiers
Preferred name
N-[(2-chloroacetyl)carbamoyl]prop-2-enamide
IUPAC
N-[(2-chloroacetyl)carbamoyl]prop-2-enamide
Names & synonyms
SCHEMBL11356010
Database identifiers
PubChem CID
23451636
Properties
Computed structural properties
XLogP
1.2
Topological polar surface area
75.3 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
3
Rotatable bonds
2
Heavy atoms
12
Formal charge
0
Complexity
227
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Related reactions
1 records
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As reactant
As product
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As solvent
HRID
301281
As product
Training data from https://doi.org/10.1039/C8SC04228D (8/10)
Compound notes
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