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2-Methoxy-6-({[4-(trifluoromethoxy)phenyl]amino}methyl)phenol

HCID 678002
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Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
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Basic information

CAS
306730-45-0
Standard SMILES
COc1cccc(CNc2ccc(OC(F)(F)F)cc2)c1O
InChIKey
AGWIHPRDOFRRBE-UHFFFAOYSA-N
Molecular formula
C15H14F3NO3
Average molar mass
313.27 g/mol
Monoisotopic mass
313.09257779

Names & identifiers

Preferred name
2-Methoxy-6-({[4-(trifluoromethoxy)phenyl]amino}methyl)phenol
IUPAC
2-methoxy-6-[[4-(trifluoromethoxy)anilino]methyl]phenol

Names & synonyms

306730-45-02-methoxy-6-({[4-(trifluoromethoxy)phenyl]amino}methyl)phenol2-methoxy-6-[[4-(trifluoromethoxy)anilino]methyl]phenol2-Methoxy-6-(((4-(trifluoromethoxy)phenyl)amino)methyl)phenol2-Methoxy-6-{[4-(trifluoromethoxy)anilino]methyl}phenol2-Methoxy-6-[[[4-(trifluoromethoxy)phenyl]amino]methyl]phenolDTXSID201182118STK900681AKOS002074351JS-0311CS-0359290AA-768/31453002
Show more names
SR-01000573448SR-01000573448-1

Database identifiers

CAS
306730-45-0
PubChem CID
678002
DTXSID
DTXSID201182118

Properties

Computed structural properties

XLogP
4.2
Topological polar surface area
50.7 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
7
Rotatable bonds
5
Heavy atoms
22
Formal charge
0
Complexity
332

Related reactions

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Compound notes

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