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Hexane, 3-acetoxy-4,4-diphenyl-6-morpholino-, hydrochloride

HCID 44811
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Basic information

CAS
63834-47-9
Standard SMILES
CCC(OC(C)=O)C(CC[NH+]1CCOCC1)(c1ccccc1)c1ccccc1.[Cl-]
InChIKey
AMETXLUKRWWYMK-UHFFFAOYSA-N
Molecular formula
C24H32ClNO3
Average molar mass
418 g/mol
Monoisotopic mass
417.2070716

Names & identifiers

Preferred name
Hexane, 3-acetoxy-4,4-diphenyl-6-morpholino-, hydrochloride
IUPAC
(6-morpholin-4-ium-4-yl-4,4-diphenylhexan-3-yl) acetate chloride

Names & synonyms

63834-47-9HEXANE, 3-ACETOXY-4,4-DIPHENYL-6-MORPHOLINO-, HYDROCHLORIDERefChem:10865763-Acetoxy-4,4-diphenyl-6-morpholinohexane hydrochloride

Database identifiers

CAS
63834-47-9
PubChem CID
44811

Properties

Computed structural properties

Topological polar surface area
40 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
4
Rotatable bonds
9
Heavy atoms
29
Formal charge
0
Complexity
444

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