2-[2,7-dibromo-9-(2-methoxyethyl)fluoren-9-yl]ethanol

C18H18Br2O2 — CID 90399566

IUPAC2-[2,7-dibromo-9-(2-methoxyethyl)fluoren-9-yl]ethanol
SMILESCOCCC1(CCO)c2cc(Br)ccc2-c2ccc(Br)cc21
InChIInChI=1S/C18H18Br2O2/c1-22-9-7-18(6-8-21)16-10-12(19)2-4-14(16)15-5-3-13(20)11-17(15)18/h2-5,10-11,21H,6-9H2,1H3
InChIKeyRHIOOKZIOOIOPY-UHFFFAOYSA-N
MW426.15 g/mol
LogP4.90
Rot. Bonds5

About 2-[2,7-dibromo-9-(2-methoxyethyl)fluoren-9-yl]ethanol

2-[2,7-dibromo-9-(2-methoxyethyl)fluoren-9-yl]ethanol (PubChem CID 90399566) has the molecular formula C18H18Br2O2 and a molecular weight of 426.15 g/mol. Its IUPAC name is 2-[2,7-dibromo-9-(2-methoxyethyl)fluoren-9-yl]ethanol.

Molecular Properties

Compound Name2-[2,7-dibromo-9-(2-methoxyethyl)fluoren-9-yl]ethanol
PubChem CID90399566
Molecular FormulaC18H18Br2O2
Molecular Weight426.15 g/mol
Exact Mass423.97
IUPAC Name2-[2,7-dibromo-9-(2-methoxyethyl)fluoren-9-yl]ethanol
SMILESCOCCC1(CCO)c2cc(Br)ccc2-c2ccc(Br)cc21
InChIInChI=1S/C18H18Br2O2/c1-22-9-7-18(6-8-21)16-10-12(19)2-4-14(16)15-5-3-13(20)11-17(15)18/h2-5,10-11,21H,6-9H2,1H3
InChIKeyRHIOOKZIOOIOPY-UHFFFAOYSA-N
XLogP4.90
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500426.15
LogP ≤ 54.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2,7-dibromo-9,9-bis[3-(2-methoxyethoxy)propyl]fluorene
CID 58473533
6-[2,7-dibromo-9-(6-hydroxyhexyl)fluoren-9-yl]hexan-1-ol
CID 86231316
2,8-dibromo-6,6,12,12-tetrakis[2-(2-ethoxyethoxy)ethyl]indeno[1,2-b]fluorene
CID 67476758
2,7-dibromo-9,9-bis(2-bromoethyl)fluorene
CID 68813933
2-bromo-7-(7-bromo-9,9-dipropylfluoren-2-yl)-9,9-dipropylfluorene
CID 90202241
2,7-dibromo-9-heptyl-9-hexylfluorene
CID 170123395
2,7-dibromo-9,9-bis(6-bromohexyl)fluorene;ethane
CID 143104175
3-[2,7-dibromo-9-(3-prop-2-enoyloxypropyl)fluoren-9-yl]propyl prop-2-enoate
CID 86606152
2,8-dibromo-6,6,12,12-tetrakis(3-bromopropyl)indeno[1,2-b]fluorene
CID 137443816
2,7-dibromo-9,9-bis(8-bromooctyl)fluorene
CID 58274129
6-[2,7-dibromo-9-(6-phosphonohexyl)fluoren-9-yl]hexylphosphonic acid
CID 141174107
[7-[7-[7-(hydroxymethyl)-9,9-bis[2-(2-methoxyethoxy)ethyl]fluoren-2-yl]-9,9-bis[2-(2-methoxyethoxy)ethyl]fluoren-2-yl]-9,9-bis[2-(2-methoxyethoxy)ethyl]fluoren-2-yl]methanol
CID 89030603

Frequently Asked Questions

What is the IUPAC name of 2-[2,7-dibromo-9-(2-methoxyethyl)fluoren-9-yl]ethanol?
The IUPAC name of 2-[2,7-dibromo-9-(2-methoxyethyl)fluoren-9-yl]ethanol (CID 90399566) is 2-[2,7-dibromo-9-(2-methoxyethyl)fluoren-9-yl]ethanol.
What is the SMILES notation for 2-[2,7-dibromo-9-(2-methoxyethyl)fluoren-9-yl]ethanol?
The canonical SMILES for 2-[2,7-dibromo-9-(2-methoxyethyl)fluoren-9-yl]ethanol is COCCC1(CCO)c2cc(Br)ccc2-c2ccc(Br)cc21.
What is the InChIKey of 2-[2,7-dibromo-9-(2-methoxyethyl)fluoren-9-yl]ethanol?
The InChIKey is RHIOOKZIOOIOPY-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18Br2O2/c1-22-9-7-18(6-8-21)16-10-12(19)2-4-14(16)15-5-3-13(20)11-17(15)18/h2-5,10-11,21H,6-9H2,1H3.
What are the key properties of 2-[2,7-dibromo-9-(2-methoxyethyl)fluoren-9-yl]ethanol?
2-[2,7-dibromo-9-(2-methoxyethyl)fluoren-9-yl]ethanol has a molecular weight of 426.15 g/mol, XLogP of 4.90, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2,7-dibromo-9-(2-methoxyethyl)fluoren-9-yl]ethanol is sourced from PubChem (CID 90399566), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).