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4-Heptanone, 2,6-bis(trifluoromethyl)-2,6-dihydroxy-1,1,1,7,7,7-hexafluoro-, phenylhydrazone

HCID 59102
NotesReactions
Basic informationNames & identifiersPropertiesChemistry & industryRelated reactionsCompound notes
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Basic information

CAS
101913-90-0
Standard SMILES
OC(CC(CC(O)(C(F)(F)F)C(F)(F)F)=NNc1ccccc1)(C(F)(F)F)C(F)(F)F
InChIKey
QUMFZWRXKISFMS-UHFFFAOYSA-N
Molecular formula
C15H12F12N2O2
Average molar mass
480.25 g/mol
Monoisotopic mass
480.0707156

Names & identifiers

Preferred name
4-Heptanone, 2,6-bis(trifluoromethyl)-2,6-dihydroxy-1,1,1,7,7,7-hexafluoro-, phenylhydrazone
IUPAC
1,1,1,7,7,7-hexafluoro-4-(phenylhydrazinylidene)-2,6-bis(trifluoromethyl)heptane-2,6-diol
English name
1,1,1,7,7,7-Hexafluoro-2,6-dihydroxy-2,6-bis(trifluoromethyl)-heptan-4 -one, phenyl hydrazone
Molecular weight
0

Names & synonyms

101913-90-04-Heptanone, 2,6-bis(trifluoromethyl)-2,6-dihydroxy-1,1,1,7,7,7-hexafluoro-, phenylhydrazoneDTXSID301443401,1,1,7,7,7-Hexafluoro-2,6-dihydroxy-2,6-bis(trifluoromethyl)-heptan-4-one, phenyl hydrazoneRefChem:293001DTXCID9066831NSC1686061,1,1,7,7,7-hexafluoro-4-(phenylhydrazinylidene)-2,6-bis(trifluoromethyl)heptane-2,6-diolNSC-1686061,1,1,7,7,7-hexafluoro-4-(2-phenylhydrazinylidene)-2,6-bis(trifluoromethyl)heptane-2,6-diol1,1,1,7,7,7-Hexafluoro-2,6-dihydroxy-2,6-bis(trifluoromethyl)-heptan-4 -one, phenyl hydrazone4-Heptanone,1,1,7,7,7-hexafluoro-2,6-dihydroxy-2,6-bis(trifluoromethyl)-, phenylhydrazone
Show more names
4-Heptanone, 1,1,1,7,7,7-hexafluoro-2,6-dihydroxy-2,6-bis(trifluoromethyl)-,?2-phenylhydrazone

Properties

Computed structural properties

XLogP
4.8
Topological polar surface area
64.9 Ų
Hydrogen bond donors
3
Hydrogen bond acceptors
16
Rotatable bonds
6
Heavy atoms
31
Formal charge
0
Complexity
560

Chemistry & industry

Suppliers1 total

HONEST JOY HOLDINGS LIMITED[email protected]

Related reactions

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Compound notes

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On this pageBasic informationNames & identifiersPropertiesChemistry & industryRelated reactionsCompound notes

Database identifiers

CAS
101913-90-0
PubChem CID
59102
DTXSID
DTXSID30144340
Nikkaji
J73.656B