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2-chloro-N-(1-hydroxy-3-methylpentan-2-yl)acetamide (HCID 4656501)|Huagongshe
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Compound
2-chloro-N-(1-hydroxy-3-methylpentan-2-yl)acetamide
HCID
4656501
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Basic information
Names & identifiers
Properties
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Compound notes
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Basic information
Standard SMILES
CCC(C)C(CO)NC(=O)CCl
InChIKey
OLLYYMGGBKLKPW-UHFFFAOYSA-N
Molecular formula
C8H16ClNO2
Average molar mass
193.67 g/mol
Names & identifiers
Preferred name
2-chloro-N-(1-hydroxy-3-methylpentan-2-yl)acetamide
IUPAC
2-chloro-N-(1-hydroxy-3-methylpentan-2-yl)acetamide
Database identifiers
PubChem CID
4656501
Properties
Computed structural properties
XLogP
1.2
Topological polar surface area
49.3 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
2
Rotatable bonds
5
Heavy atoms
12
Formal charge
0
Complexity
141
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Related reactions
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As reactant
As product
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As solvent
HRID
188731
As product
Training data from https://doi.org/10.1039/C8SC04228D (6/10)
Compound notes
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