6,11-Dihydrodibenzo[b,e]thiepin-11-ol

HCID 601431

Basic information

Standard SMILES
OC1c2ccccc2CSc2ccccc21
InChIKey
JLRRONOEUGUFFI-UHFFFAOYSA-N
Molecular formula
C14H12OS
Average molar mass
228.31 g/mol

Names & identifiers

Preferred name
6,11-Dihydrodibenzo[b,e]thiepin-11-ol
IUPAC
6,11-dihydrobenzo[c][1]benzothiepin-11-ol

Names & synonyms

6,11-Dihydrodibenzo[b,e]thiepin-11-ol1745-46-66,11-dihydrobenzo[c][1]benzothiepin-11-ol6,11-Dihydrodibenzo(b,E)thiepin-11-olMFCD299186535,11-Dihydro-10-thia-dibenzo[a,d]cyclohepten-5-ol5,11-Dihydro-10-thiadibenzo[a,d]cyclohepten-5-olBaloxavir Impurity 88starbld0017047SCHEMBL2126069AKOS005216212AS-6355
Show more names
6,11-dihydro-dibenzo[b,e]thiepin-11-ol6.11-dihydro-dibenzo[b,e]thiepin-11-ol11-hydroxy-6,11-dihydrodibenz[b,e]thiepinG65443F511179

Database identifiers

PubChem CID
601431
Nikkaji
J236.404B

Properties

Computed structural properties

XLogP
2.8
Topological polar surface area
45.5 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
2
Rotatable bonds
0
Heavy atoms
16

Related reactions

13 records

Compound notes

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