2-(4-chlorophenyl)-7-ethyl-9,10-dihydrophenanthrene

C22H19Cl — CID 139883299

IUPAC2-(4-chlorophenyl)-7-ethyl-9,10-dihydrophenanthrene
SMILESCCc1ccc2c(c1)CCc1cc(-c3ccc(Cl)cc3)ccc1-2
InChIInChI=1S/C22H19Cl/c1-2-15-3-11-21-18(13-15)4-5-19-14-17(8-12-22(19)21)16-6-9-20(23)10-7-16/h3,6-14H,2,4-5H2,1H3
InChIKeyPGBSBFBRDMUVMD-UHFFFAOYSA-N
MW318.85 g/mol
LogP6.34
Rot. Bonds2

About 2-(4-chlorophenyl)-7-ethyl-9,10-dihydrophenanthrene

2-(4-chlorophenyl)-7-ethyl-9,10-dihydrophenanthrene (PubChem CID 139883299) has the molecular formula C22H19Cl and a molecular weight of 318.85 g/mol. Its IUPAC name is 2-(4-chlorophenyl)-7-ethyl-9,10-dihydrophenanthrene.

Molecular Properties

Compound Name2-(4-chlorophenyl)-7-ethyl-9,10-dihydrophenanthrene
PubChem CID139883299
Molecular FormulaC22H19Cl
Molecular Weight318.85 g/mol
Exact Mass318.12
IUPAC Name2-(4-chlorophenyl)-7-ethyl-9,10-dihydrophenanthrene
SMILESCCc1ccc2c(c1)CCc1cc(-c3ccc(Cl)cc3)ccc1-2
InChIInChI=1S/C22H19Cl/c1-2-15-3-11-21-18(13-15)4-5-19-14-17(8-12-22(19)21)16-6-9-20(23)10-7-16/h3,6-14H,2,4-5H2,1H3
InChIKeyPGBSBFBRDMUVMD-UHFFFAOYSA-N
XLogP6.34
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500318.85
LogP ≤ 56.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

2-(4-chloro-3-fluorophenyl)-7-ethyl-9,10-dihydrophenanthrene
CID 139883517
2-(4-chlorophenyl)-7-ethyl-3-fluoro-9,10-dihydrophenanthrene
CID 139883628
2-[3,5-difluoro-4-(trifluoromethyl)phenyl]-7-ethyl-9,10-dihydrophenanthrene
CID 139883642
2-(3,4-difluorophenyl)-7-ethyl-1-fluoro-9,10-dihydrophenanthrene
CID 139884423
7-butyl-2-(4-chlorophenyl)-3-fluoro-9,10-dihydrophenanthrene
CID 139883454
2-(4-chlorophenyl)-1,3-difluoro-7-propyl-9,10-dihydrophenanthrene
CID 22045499
1-chloro-4-[2-(4-ethylphenyl)phenyl]benzene
CID 166659313
2,7-dipropyl-9,10-dihydrophenanthrene
CID 159085021
1-[6-(4-chlorophenyl)-1-phenyl-3,4-dihydronaphthalen-2-yl]-N,N-dimethylmethanamine
CID 57048109
6-ethyltricyclo[9.4.0.03,8]pentadeca-1(15),3(8),4,6,11,13-hexaen-2-one
CID 22117289
7-(4-chlorophenyl)-2-ethyldibenzothiophene
CID 164852807
4-ethyl-1-[4-(4-ethylphenyl)phenyl]-2-fluorobenzene
CID 129263989

Frequently Asked Questions

What is the IUPAC name of 2-(4-chlorophenyl)-7-ethyl-9,10-dihydrophenanthrene?
The IUPAC name of 2-(4-chlorophenyl)-7-ethyl-9,10-dihydrophenanthrene (CID 139883299) is 2-(4-chlorophenyl)-7-ethyl-9,10-dihydrophenanthrene.
What is the SMILES notation for 2-(4-chlorophenyl)-7-ethyl-9,10-dihydrophenanthrene?
The canonical SMILES for 2-(4-chlorophenyl)-7-ethyl-9,10-dihydrophenanthrene is CCc1ccc2c(c1)CCc1cc(-c3ccc(Cl)cc3)ccc1-2.
What is the InChIKey of 2-(4-chlorophenyl)-7-ethyl-9,10-dihydrophenanthrene?
The InChIKey is PGBSBFBRDMUVMD-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H19Cl/c1-2-15-3-11-21-18(13-15)4-5-19-14-17(8-12-22(19)21)16-6-9-20(23)10-7-16/h3,6-14H,2,4-5H2,1H3.
What are the key properties of 2-(4-chlorophenyl)-7-ethyl-9,10-dihydrophenanthrene?
2-(4-chlorophenyl)-7-ethyl-9,10-dihydrophenanthrene has a molecular weight of 318.85 g/mol, XLogP of 6.34, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-chlorophenyl)-7-ethyl-9,10-dihydrophenanthrene is sourced from PubChem (CID 139883299), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).