CID 173482166

C17H17B — CID 173482166

IUPAC—
SMILES[B]c1ccc2c(c1)C(CC)(CC)c1ccccc1-2
InChIInChI=1S/C17H17B/c1-3-17(4-2)15-8-6-5-7-13(15)14-10-9-12(18)11-16(14)17/h5-11H,3-4H2,1-2H3
InChIKeyRBDQALWZMVMWKA-UHFFFAOYSA-N
MW232.13 g/mol
LogP3.57
Rot. Bonds2

About CID 173482166

CID 173482166 (PubChem CID 173482166) has the molecular formula C17H17B and a molecular weight of 232.13 g/mol.

Molecular Properties

Compound NameCID 173482166
PubChem CID173482166
Molecular FormulaC17H17B
Molecular Weight232.13 g/mol
Exact Mass232.14
IUPAC Name—
SMILES[B]c1ccc2c(c1)C(CC)(CC)c1ccccc1-2
InChIInChI=1S/C17H17B/c1-3-17(4-2)15-8-6-5-7-13(15)14-10-9-12(18)11-16(14)17/h5-11H,3-4H2,1-2H3
InChIKeyRBDQALWZMVMWKA-UHFFFAOYSA-N
XLogP3.57
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.13
LogP ≤ 53.57
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

9,9-diethylfluoren-2-ol
CID 163996675
bis(9,9-diethylfluoren-2-yl)borinic acid
CID 140671655
CID 147413538
CID 147413538
2-(diiodomethyl)-9,9-diethylfluorene
CID 142719764
2-N,2-N,7-N-tris(9,9-diethylfluoren-2-yl)-9,9-diethyl-7-N-phenylfluorene-2,7-diamine
CID 23561815
2,7-bis[7-(9,9-diethylfluoren-2-yl)-9,9-dimethylfluoren-2-yl]-9,9-dimethylfluorene;2-(9,9-diethylfluoren-2-yl)-7-[7-(9,9-dimethylfluoren-2-yl)-9,9-diethylfluoren-2-yl]-9,9-diethylfluorene;2-(9,9-diethylfluoren-2-yl)-7-[7-(9,9-dimethylfluoren-2-yl)-9,9-dimethylfluoren-2-yl]-9,9-diethylfluorene;2-(9,9-diethylfluoren-2-yl)-7-[7-(9,9-dimethylfluoren-2-yl)-9,9-dimethylfluoren-2-yl]-9,9-dimethylfluorene
CID 160707659
2-(9,9-diethylfluoren-2-yl)-7-[7-(9,9-dimethylfluoren-2-yl)-9,9-dimethylfluoren-2-yl]-9,9-dimethylfluorene
CID 58939612
2,7-bis(9,9-diethylfluoren-2-yl)-9,9-diethyl-3,6-dimethylfluorene
CID 59782418
1-(9,9-diethylfluoren-2-yl)propan-1-one
CID 122485363
6,15,24-tris(9,9-diethylfluoren-2-yl)-9,9,18,18,21,21-hexaethylheptacyclo[18.7.0.02,10.03,8.011,19.012,17.022,27]heptacosa-1,3(8),4,6,10,12(17),13,15,19,22(27),23,25-dodecaene
CID 102150204
2-N',2-N',7-N',7-N'-tetrakis(9,9-diethylfluoren-2-yl)-2-N,2-N,7-N,7-N-tetraphenyl-9,9'-spirobi[fluorene]-2,2',7,7'-tetramine
CID 121276321
9-ethyl-9-propylfluorene
CID 123584741

Frequently Asked Questions

What is the IUPAC name of CID 173482166?
The IUPAC name of CID 173482166 (CID 173482166) is not available.
What is the SMILES notation for CID 173482166?
The canonical SMILES for CID 173482166 is [B]c1ccc2c(c1)C(CC)(CC)c1ccccc1-2.
What is the InChIKey of CID 173482166?
The InChIKey is RBDQALWZMVMWKA-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17B/c1-3-17(4-2)15-8-6-5-7-13(15)14-10-9-12(18)11-16(14)17/h5-11H,3-4H2,1-2H3.
What are the key properties of CID 173482166?
CID 173482166 has a molecular weight of 232.13 g/mol, XLogP of 3.57, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for CID 173482166 is sourced from PubChem (CID 173482166), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).