1-chloro-2-[2-(1-chloro-9H-fluoren-2-yl)ethyl]-9H-fluorene;titanium

C28H20Cl2Ti — CID 87867259

IUPAC1-chloro-2-[2-(1-chloro-9H-fluoren-2-yl)ethyl]-9H-fluorene;titanium
SMILESClc1c(CCc2ccc3c(c2Cl)Cc2ccccc2-3)ccc2c1Cc1ccccc1-2.[Ti]
InChIInChI=1S/C28H20Cl2.Ti/c29-27-17(11-13-23-21-7-3-1-5-19(21)15-25(23)27)9-10-18-12-14-24-22-8-4-2-6-20(22)16-26(24)28(18)30;/h1-8,11-14H,9-10,15-16H2;
InChIKeyBKDCUJFMCJKUNT-UHFFFAOYSA-N
MW475.24 g/mol
LogP7.92
Rot. Bonds3

About 1-chloro-2-[2-(1-chloro-9H-fluoren-2-yl)ethyl]-9H-fluorene;titanium

1-chloro-2-[2-(1-chloro-9H-fluoren-2-yl)ethyl]-9H-fluorene;titanium (PubChem CID 87867259) has the molecular formula C28H20Cl2Ti and a molecular weight of 475.24 g/mol. Its IUPAC name is 1-chloro-2-[2-(1-chloro-9H-fluoren-2-yl)ethyl]-9H-fluorene;titanium.

Molecular Properties

Compound Name1-chloro-2-[2-(1-chloro-9H-fluoren-2-yl)ethyl]-9H-fluorene;titanium
PubChem CID87867259
Molecular FormulaC28H20Cl2Ti
Molecular Weight475.24 g/mol
Exact Mass474.04
IUPAC Name1-chloro-2-[2-(1-chloro-9H-fluoren-2-yl)ethyl]-9H-fluorene;titanium
SMILESClc1c(CCc2ccc3c(c2Cl)Cc2ccccc2-3)ccc2c1Cc1ccccc1-2.[Ti]
InChIInChI=1S/C28H20Cl2.Ti/c29-27-17(11-13-23-21-7-3-1-5-19(21)15-25(23)27)9-10-18-12-14-24-22-8-4-2-6-20(22)16-26(24)28(18)30;/h1-8,11-14H,9-10,15-16H2;
InChIKeyBKDCUJFMCJKUNT-UHFFFAOYSA-N
XLogP7.92
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms31
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500475.24
LogP ≤ 57.92
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

2-[2-(2-chlorophenyl)ethyl]-9H-fluoren-1-amine
CID 151484555
1-(9H-fluoren-1-yl)-9H-fluorene
CID 19077838
1,2-diethyl-9H-fluorene
CID 23440471
2-chloro-9H-fluoren-1-amine
CID 150811433
CID 123562270
CID 123562270
1,2-bis(6-bromohexyl)-9H-fluorene
CID 172692386
2-methyl-1-[2-(2-methyl-9H-fluoren-1-yl)ethyl]-9H-fluorene
CID 22912619
2-[(1-chloro-9H-fluoren-2-yl)oxy]ethyl-trimethylsilane
CID 152525917
3-(1-amino-9H-fluoren-2-yl)propanenitrile
CID 152647323
1,2-dihexyl-9H-fluorene
CID 22141601
1-methyl-2-(2-methylpropyl)-9H-fluorene
CID 159171549
1-ethenyl-2-ethyl-9H-fluorene
CID 158586423

Frequently Asked Questions

What is the IUPAC name of 1-chloro-2-[2-(1-chloro-9H-fluoren-2-yl)ethyl]-9H-fluorene;titanium?
The IUPAC name of 1-chloro-2-[2-(1-chloro-9H-fluoren-2-yl)ethyl]-9H-fluorene;titanium (CID 87867259) is 1-chloro-2-[2-(1-chloro-9H-fluoren-2-yl)ethyl]-9H-fluorene;titanium.
What is the SMILES notation for 1-chloro-2-[2-(1-chloro-9H-fluoren-2-yl)ethyl]-9H-fluorene;titanium?
The canonical SMILES for 1-chloro-2-[2-(1-chloro-9H-fluoren-2-yl)ethyl]-9H-fluorene;titanium is Clc1c(CCc2ccc3c(c2Cl)Cc2ccccc2-3)ccc2c1Cc1ccccc1-2.[Ti].
What is the InChIKey of 1-chloro-2-[2-(1-chloro-9H-fluoren-2-yl)ethyl]-9H-fluorene;titanium?
The InChIKey is BKDCUJFMCJKUNT-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H20Cl2.Ti/c29-27-17(11-13-23-21-7-3-1-5-19(21)15-25(23)27)9-10-18-12-14-24-22-8-4-2-6-20(22)16-26(24)28(18)30;/h1-8,11-14H,9-10,15-16H2;.
What are the key properties of 1-chloro-2-[2-(1-chloro-9H-fluoren-2-yl)ethyl]-9H-fluorene;titanium?
1-chloro-2-[2-(1-chloro-9H-fluoren-2-yl)ethyl]-9H-fluorene;titanium has a molecular weight of 475.24 g/mol, XLogP of 7.92, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-chloro-2-[2-(1-chloro-9H-fluoren-2-yl)ethyl]-9H-fluorene;titanium is sourced from PubChem (CID 87867259), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).