7-chloro-1-iodo-9,9-dimethylfluorene

C15H12ClI — CID 139958810

IUPAC7-chloro-1-iodo-9,9-dimethylfluorene
SMILESCC1(C)c2cc(Cl)ccc2-c2cccc(I)c21
InChIInChI=1S/C15H12ClI/c1-15(2)12-8-9(16)6-7-10(12)11-4-3-5-13(17)14(11)15/h3-8H,1-2H3
InChIKeyUBTHWVSTVGOFLZ-UHFFFAOYSA-N
MW354.62 g/mol
LogP5.25
Rot. Bonds

About 7-chloro-1-iodo-9,9-dimethylfluorene

7-chloro-1-iodo-9,9-dimethylfluorene (PubChem CID 139958810) has the molecular formula C15H12ClI and a molecular weight of 354.62 g/mol. Its IUPAC name is 7-chloro-1-iodo-9,9-dimethylfluorene.

Molecular Properties

Compound Name7-chloro-1-iodo-9,9-dimethylfluorene
PubChem CID139958810
Molecular FormulaC15H12ClI
Molecular Weight354.62 g/mol
Exact Mass353.97
IUPAC Name7-chloro-1-iodo-9,9-dimethylfluorene
SMILESCC1(C)c2cc(Cl)ccc2-c2cccc(I)c21
InChIInChI=1S/C15H12ClI/c1-15(2)12-8-9(16)6-7-10(12)11-4-3-5-13(17)14(11)15/h3-8H,1-2H3
InChIKeyUBTHWVSTVGOFLZ-UHFFFAOYSA-N
XLogP5.25
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms17
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500354.62
LogP ≤ 55.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

7-chloro-1-(9,9-dimethylfluoren-1-yl)-9,9-dimethylfluorene
CID 171439038
7-chloro-9,9-dimethyl-N,N-diphenylfluoren-1-amine
CID 165158530
2'-chloro-9,9-dimethylspiro[anthracene-10,9'-fluorene]
CID 138667036
1-(4-chlorophenyl)-9,9-dimethylfluorene
CID 118193752
7-chloro-1-iodo-9H-fluorene
CID 139958813
CID 102192841
CID 102192841
5-chloro-2-(9,9-dimethylfluoren-1-yl)benzaldehyde;5-chloro-2-(9,9-dimethylfluoren-1-yl)benzoic acid
CID 159288888
5-bromo-3-chloro-9,9-dimethylfluorene
CID 175668699
2-chlorospiro[benzo[a]fluorene-11,9'-fluorene]
CID 145144854
7-chloro-2,4-difluoro-9,9-dimethylfluorene
CID 156704590
2-chloro-7-(9,9-dioctylfluoren-2-yl)-9,9-dimethylfluorene
CID 138569718
2-[9,9-dimethyl-7-(2-phenylphenyl)fluoren-2-yl]-7-[7-(2,6-diphenylphenyl)-9,9-dimethylfluoren-2-yl]-9,9-dimethylfluorene
CID 58881185

Frequently Asked Questions

What is the IUPAC name of 7-chloro-1-iodo-9,9-dimethylfluorene?
The IUPAC name of 7-chloro-1-iodo-9,9-dimethylfluorene (CID 139958810) is 7-chloro-1-iodo-9,9-dimethylfluorene.
What is the SMILES notation for 7-chloro-1-iodo-9,9-dimethylfluorene?
The canonical SMILES for 7-chloro-1-iodo-9,9-dimethylfluorene is CC1(C)c2cc(Cl)ccc2-c2cccc(I)c21.
What is the InChIKey of 7-chloro-1-iodo-9,9-dimethylfluorene?
The InChIKey is UBTHWVSTVGOFLZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12ClI/c1-15(2)12-8-9(16)6-7-10(12)11-4-3-5-13(17)14(11)15/h3-8H,1-2H3.
What are the key properties of 7-chloro-1-iodo-9,9-dimethylfluorene?
7-chloro-1-iodo-9,9-dimethylfluorene has a molecular weight of 354.62 g/mol, XLogP of 5.25, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 7-chloro-1-iodo-9,9-dimethylfluorene is sourced from PubChem (CID 139958810), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).