2-(7-bromo-9H-fluoren-2-yl)-2-(chloromethyl)-1,3-dioxolane

C17H14BrClO2 — CID 145082429

IUPAC2-(7-bromo-9H-fluoren-2-yl)-2-(chloromethyl)-1,3-dioxolane
SMILESClCC1(c2ccc3c(c2)Cc2cc(Br)ccc2-3)OCCO1
InChIInChI=1S/C17H14BrClO2/c18-14-2-4-16-12(9-14)7-11-8-13(1-3-15(11)16)17(10-19)20-5-6-21-17/h1-4,8-9H,5-7,10H2
InChIKeyRSLNSVZRIFZZIR-UHFFFAOYSA-N
MW365.65 g/mol
LogP4.46
Rot. Bonds2

About 2-(7-bromo-9H-fluoren-2-yl)-2-(chloromethyl)-1,3-dioxolane

2-(7-bromo-9H-fluoren-2-yl)-2-(chloromethyl)-1,3-dioxolane (PubChem CID 145082429) has the molecular formula C17H14BrClO2 and a molecular weight of 365.65 g/mol. Its IUPAC name is 2-(7-bromo-9H-fluoren-2-yl)-2-(chloromethyl)-1,3-dioxolane.

Molecular Properties

Compound Name2-(7-bromo-9H-fluoren-2-yl)-2-(chloromethyl)-1,3-dioxolane
PubChem CID145082429
Molecular FormulaC17H14BrClO2
Molecular Weight365.65 g/mol
Exact Mass363.99
IUPAC Name2-(7-bromo-9H-fluoren-2-yl)-2-(chloromethyl)-1,3-dioxolane
SMILESClCC1(c2ccc3c(c2)Cc2cc(Br)ccc2-3)OCCO1
InChIInChI=1S/C17H14BrClO2/c18-14-2-4-16-12(9-14)7-11-8-13(1-3-15(11)16)17(10-19)20-5-6-21-17/h1-4,8-9H,5-7,10H2
InChIKeyRSLNSVZRIFZZIR-UHFFFAOYSA-N
XLogP4.46
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500365.65
LogP ≤ 54.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'alkyl_halide', 'substructure': 'N/A'}

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Related Compounds

2-(7-Bromo-9,9-difluorofluoren-2-yl)-2-(chloromethyl)-5,5-dimethyl-1,3-dioxane
CID 145082417
2-(7-Bromo-9,9-difluorofluoren-2-yl)-2-methyl-1,3-dioxolane
CID 145082420
2-(7-Bromo-9,9-difluorofluoren-2-yl)-2-(chloromethyl)-1,3-dioxolane
CID 145082421
2-(7-Bromo-9,9-difluorofluoren-2-yl)-1,3-dioxolane
CID 171758092
2',7'-Dibromospiro[1,3-dioxolane-2,9'-fluorene]
CID 69294899
Spiro[4H-cyclopenta[def]phenanthrene-4,2'-[1,3]dioxolane], 8-bromo-
CID 629870
2-(bromomethyl)-2-(9H-fluoren-2-yl)-1,3-dioxolane
CID 21313220
2-(6-bromo-2,3-dihydro-1H-inden-5-yl)-1,3-dioxolane
CID 59799526
5-Bromo-6-methylspiro[1,2-dihydroindene-3,2'-1,3-dioxolane]
CID 69201749
2-(7-bromo-9H-fluoren-2-yl)-1,3-dioxolane
CID 89643767
2-(7-Bromo-9,9-dioctylfluoren-2-yl)-1,3-dioxolane
CID 129302662
2-(7-Bromo-9,9-dimethylfluoren-2-yl)-1,3-dioxolane
CID 138708118

Frequently Asked Questions

What is the IUPAC name of 2-(7-bromo-9H-fluoren-2-yl)-2-(chloromethyl)-1,3-dioxolane?
The IUPAC name of 2-(7-bromo-9H-fluoren-2-yl)-2-(chloromethyl)-1,3-dioxolane (CID 145082429) is 2-(7-bromo-9H-fluoren-2-yl)-2-(chloromethyl)-1,3-dioxolane.
What is the SMILES notation for 2-(7-bromo-9H-fluoren-2-yl)-2-(chloromethyl)-1,3-dioxolane?
The canonical SMILES for 2-(7-bromo-9H-fluoren-2-yl)-2-(chloromethyl)-1,3-dioxolane is ClCC1(c2ccc3c(c2)Cc2cc(Br)ccc2-3)OCCO1.
What is the InChIKey of 2-(7-bromo-9H-fluoren-2-yl)-2-(chloromethyl)-1,3-dioxolane?
The InChIKey is RSLNSVZRIFZZIR-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H14BrClO2/c18-14-2-4-16-12(9-14)7-11-8-13(1-3-15(11)16)17(10-19)20-5-6-21-17/h1-4,8-9H,5-7,10H2.
What are the key properties of 2-(7-bromo-9H-fluoren-2-yl)-2-(chloromethyl)-1,3-dioxolane?
2-(7-bromo-9H-fluoren-2-yl)-2-(chloromethyl)-1,3-dioxolane has a molecular weight of 365.65 g/mol, XLogP of 4.46, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(7-bromo-9H-fluoren-2-yl)-2-(chloromethyl)-1,3-dioxolane is sourced from PubChem (CID 145082429), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).