3-methoxy-10-(trifluoromethyl)-9,10-dihydrophenanthrene

C16H13F3O — CID 156693022

IUPAC3-methoxy-10-(trifluoromethyl)-9,10-dihydrophenanthrene
SMILESCOc1ccc2c(c1)-c1ccccc1CC2C(F)(F)F
InChIInChI=1S/C16H13F3O/c1-20-11-6-7-13-14(9-11)12-5-3-2-4-10(12)8-15(13)16(17,18)19/h2-7,9,15H,8H2,1H3
InChIKeyVIMOOTLVBHDZGA-UHFFFAOYSA-N
MW278.27 g/mol
LogP4.56
Rot. Bonds1

About 3-methoxy-10-(trifluoromethyl)-9,10-dihydrophenanthrene

3-methoxy-10-(trifluoromethyl)-9,10-dihydrophenanthrene (PubChem CID 156693022) has the molecular formula C16H13F3O and a molecular weight of 278.27 g/mol. Its IUPAC name is 3-methoxy-10-(trifluoromethyl)-9,10-dihydrophenanthrene.

Molecular Properties

Compound Name3-methoxy-10-(trifluoromethyl)-9,10-dihydrophenanthrene
PubChem CID156693022
Molecular FormulaC16H13F3O
Molecular Weight278.27 g/mol
Exact Mass278.09
IUPAC Name3-methoxy-10-(trifluoromethyl)-9,10-dihydrophenanthrene
SMILESCOc1ccc2c(c1)-c1ccccc1CC2C(F)(F)F
InChIInChI=1S/C16H13F3O/c1-20-11-6-7-13-14(9-11)12-5-3-2-4-10(12)8-15(13)16(17,18)19/h2-7,9,15H,8H2,1H3
InChIKeyVIMOOTLVBHDZGA-UHFFFAOYSA-N
XLogP4.56
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.27
LogP ≤ 54.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze 3-methoxy-10-(trifluoromethyl)-9,10-dihydrophenanthrene with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-methoxy-6H-benzo[c]chromene
CID 10798586
9-bromo-6-methoxytricyclo[9.4.0.03,8]pentadeca-1(15),3(8),4,6,11,13-hexaen-2-one
CID 10032005
7-methoxy-10H-phenanthren-9-one
CID 135042116
3-methoxy-9,10-dihydrophenanthrene-9-carboxamide
CID 154254625
9-cyclopenta-1,4-dien-1-yl-3-methoxy-9H-fluorene
CID 23213774
ethane;5-methoxytricyclo[9.4.0.03,8]pentadeca-1(15),3(8),4,6,11,13-hexaen-2-one
CID 90841573
2-methoxy-7-(trifluoromethoxy)-9,10-dihydrophenanthrene
CID 18377970
9-methoxy-5,5a,6,10b-tetrahydroindeno[2,1-b]indole
CID 22408501
9H-fluoren-3-yl trifluoromethanesulfonate
CID 155935169
2-cyclopropyl-4-methoxy-1-phenylbenzene
CID 173009156
3-bromo-6-methoxy-2,3-dihydroinden-1-one
CID 23250652
2-methoxy-5-methyl-6,10b-dihydro-5aH-indeno[2,1-b]indole
CID 167260146

Frequently Asked Questions

What is the IUPAC name of 3-methoxy-10-(trifluoromethyl)-9,10-dihydrophenanthrene?
The IUPAC name of 3-methoxy-10-(trifluoromethyl)-9,10-dihydrophenanthrene (CID 156693022) is 3-methoxy-10-(trifluoromethyl)-9,10-dihydrophenanthrene.
What is the SMILES notation for 3-methoxy-10-(trifluoromethyl)-9,10-dihydrophenanthrene?
The canonical SMILES for 3-methoxy-10-(trifluoromethyl)-9,10-dihydrophenanthrene is COc1ccc2c(c1)-c1ccccc1CC2C(F)(F)F.
What is the InChIKey of 3-methoxy-10-(trifluoromethyl)-9,10-dihydrophenanthrene?
The InChIKey is VIMOOTLVBHDZGA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H13F3O/c1-20-11-6-7-13-14(9-11)12-5-3-2-4-10(12)8-15(13)16(17,18)19/h2-7,9,15H,8H2,1H3.
What are the key properties of 3-methoxy-10-(trifluoromethyl)-9,10-dihydrophenanthrene?
3-methoxy-10-(trifluoromethyl)-9,10-dihydrophenanthrene has a molecular weight of 278.27 g/mol, XLogP of 4.56, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methoxy-10-(trifluoromethyl)-9,10-dihydrophenanthrene is sourced from PubChem (CID 156693022), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).