2-dichlorophosphoryloxy-9,9-dimethylfluorene

C15H13Cl2O2P — CID 59489047

IUPAC2-dichlorophosphoryloxy-9,9-dimethylfluorene
SMILESCC1(C)c2ccccc2-c2ccc(OP(=O)(Cl)Cl)cc21
InChIInChI=1S/C15H13Cl2O2P/c1-15(2)13-6-4-3-5-11(13)12-8-7-10(9-14(12)15)19-20(16,17)18/h3-9H,1-2H3
InChIKeyAGRNYLBXNHXLMX-UHFFFAOYSA-N
MW327.15 g/mol
LogP5.96
Rot. Bonds2

About 2-dichlorophosphoryloxy-9,9-dimethylfluorene

2-dichlorophosphoryloxy-9,9-dimethylfluorene (PubChem CID 59489047) has the molecular formula C15H13Cl2O2P and a molecular weight of 327.15 g/mol. Its IUPAC name is 2-dichlorophosphoryloxy-9,9-dimethylfluorene.

Molecular Properties

Compound Name2-dichlorophosphoryloxy-9,9-dimethylfluorene
PubChem CID59489047
Molecular FormulaC15H13Cl2O2P
Molecular Weight327.15 g/mol
Exact Mass326.00
IUPAC Name2-dichlorophosphoryloxy-9,9-dimethylfluorene
SMILESCC1(C)c2ccccc2-c2ccc(OP(=O)(Cl)Cl)cc21
InChIInChI=1S/C15H13Cl2O2P/c1-15(2)13-6-4-3-5-11(13)12-8-7-10(9-14(12)15)19-20(16,17)18/h3-9H,1-2H3
InChIKeyAGRNYLBXNHXLMX-UHFFFAOYSA-N
XLogP5.96
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500327.15
LogP ≤ 55.96
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

9,9-dimethyl-2-(2-methylphenoxy)fluorene
CID 138495913
10,10-dimethylpentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(21),2,4,6,8,11,13,15,17,19-decaene;ethane
CID 91112944
2-[6-(9,9-dimethylfluoren-2-yl)naphthalen-2-yl]-9,9-dimethylfluorene
CID 59133445
2-[6-[6-(9,9-dimethylfluoren-2-yl)naphthalen-2-yl]naphthalen-2-yl]-9,9-dimethylfluorene
CID 58351434
2-[3,5-bis[7-[7-[7-(9,9-dimethylfluoren-2-yl)-9,9-dimethylfluoren-2-yl]-9,9-dimethylfluoren-2-yl]-9,9-dimethylfluoren-2-yl]phenyl]-7-[7-[7-(9,9-dimethylfluoren-2-yl)-9,9-dimethylfluoren-2-yl]-9,9-dimethylfluoren-2-yl]-9,9-dimethylfluorene
CID 101336380
9,9-dimethylfluoren-2-amine;sulfane
CID 142283327
2,7-bis[3,5-bis[3,5-bis(9,9-dimethylfluoren-2-yl)phenyl]phenyl]-9,9-dimethylfluorene
CID 58881238
2-(9,9-dimethylfluoren-2-yl)-7-[6-(6-methoxynaphthalen-2-yl)naphthalen-2-yl]-9,9-dimethylfluorene
CID 90394242
N,N-bis(4-methoxyphenyl)-9,9-dimethylfluoren-2-amine
CID 20734434
ethane;methane;2,9,9-trimethylfluorene
CID 144920604
2-[4-(9,9-dimethylfluoren-2-yl)naphthalen-1-yl]-9,9-dimethylfluorene
CID 59133432
5-methoxy-8,8-dimethylhexacyclo[10.9.2.02,7.09,22.013,18.019,23]tricosa-1(22),2(7),3,5,9,11,13,15,17,19(23),20-undecaene
CID 59002171

Frequently Asked Questions

What is the IUPAC name of 2-dichlorophosphoryloxy-9,9-dimethylfluorene?
The IUPAC name of 2-dichlorophosphoryloxy-9,9-dimethylfluorene (CID 59489047) is 2-dichlorophosphoryloxy-9,9-dimethylfluorene.
What is the SMILES notation for 2-dichlorophosphoryloxy-9,9-dimethylfluorene?
The canonical SMILES for 2-dichlorophosphoryloxy-9,9-dimethylfluorene is CC1(C)c2ccccc2-c2ccc(OP(=O)(Cl)Cl)cc21.
What is the InChIKey of 2-dichlorophosphoryloxy-9,9-dimethylfluorene?
The InChIKey is AGRNYLBXNHXLMX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13Cl2O2P/c1-15(2)13-6-4-3-5-11(13)12-8-7-10(9-14(12)15)19-20(16,17)18/h3-9H,1-2H3.
What are the key properties of 2-dichlorophosphoryloxy-9,9-dimethylfluorene?
2-dichlorophosphoryloxy-9,9-dimethylfluorene has a molecular weight of 327.15 g/mol, XLogP of 5.96, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-dichlorophosphoryloxy-9,9-dimethylfluorene is sourced from PubChem (CID 59489047), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).