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Acetamide, 2-chloro-N-(2-ethyl-6-(hydroxymethyl)phenyl)-N-(2-methoxy-1-methylethyl)-

HCID 180699
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Basic information

CAS
96394-97-7
Standard SMILES
CCc1cccc(CO)c1N(C(=O)CCl)C(C)COC
InChIKey
NSSANYABZCITBA-UHFFFAOYSA-N
Molecular formula
C15H22ClNO3
Average molar mass
299.79 g/mol
Monoisotopic mass
299.1288213

Names & identifiers

Preferred name
Acetamide, 2-chloro-N-(2-ethyl-6-(hydroxymethyl)phenyl)-N-(2-methoxy-1-methylethyl)-
IUPAC
2-chloro-N-[2-ethyl-6-(hydroxymethyl)phenyl]-N-(1-methoxypropan-2-yl)acetamide

Names & synonyms

96394-97-7Acetamide, 2-chloro-N-(2-ethyl-6-(hydroxymethyl)phenyl)-N-(2-methoxy-1-methylethyl)-RefChem:3147112-chloro-N-[2-ethyl-6-(hydroxymethyl)phenyl]-N-(1-methoxypropan-2-yl)acetamideDTXSID509145422-chloro-N-(2-ethyl-6-hydroxymethylphenyl)-N-(2-methoxy-1-methylethyl)acetamide

Database identifiers

CAS
96394-97-7
PubChem CID
180699
DTXSID
DTXSID50914542
Nikkaji
J806.826G

Properties

Computed structural properties

XLogP
1.9
Topological polar surface area
49.8 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
3
Rotatable bonds
7
Heavy atoms
20
Formal charge
0
Complexity
301

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Compound notes

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