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5,5-Dimethyl-N-phenyl-1,3-dioxan-2-amine

HCID 85583304
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Basic information

CAS
119385-81-8
Standard SMILES
CC1(C)COC(Nc2ccccc2)OC1
InChIKey
HTXUOFFJHPLZDX-UHFFFAOYSA-N
Molecular formula
C12H17NO2
Average molar mass
207.27 g/mol
Monoisotopic mass
207.12592879

Names & identifiers

Preferred name
5,5-Dimethyl-N-phenyl-1,3-dioxan-2-amine
IUPAC
5,5-dimethyl-N-phenyl-1,3-dioxan-2-amine

Names & synonyms

DTXSID3012771645,5-Dimethyl-N-phenyl-1,3-dioxan-2-amine119385-81-8

Database identifiers

CAS
119385-81-8
PubChem CID
85583304
DTXSID
DTXSID301277164

Properties

Computed structural properties

XLogP
2.8
Topological polar surface area
30.5 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
3
Rotatable bonds
2
Heavy atoms
15
Formal charge
0
Complexity
190

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Compound notes

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