9,9-bis(6-methylnaphthalen-2-yl)fluorene;ethane

C37H32 — CID 145302395

IUPAC9,9-bis(6-methylnaphthalen-2-yl)fluorene;ethane
SMILESCC.Cc1ccc2cc(C3(c4ccc5cc(C)ccc5c4)c4ccccc4-c4ccccc43)ccc2c1
InChIInChI=1S/C35H26.C2H6/c1-23-11-13-27-21-29(17-15-25(27)19-23)35(30-18-16-26-20-24(2)12-14-28(26)22-30)33-9-5-3-7-31(33)32-8-4-6-10-34(32)35;1-2/h3-22H,1-2H3;1-2H3
InChIKeyPUWBRUGTPNLFEA-UHFFFAOYSA-N
MW476.66 g/mol
LogP10.00
Rot. Bonds2

About 9,9-bis(6-methylnaphthalen-2-yl)fluorene;ethane

9,9-bis(6-methylnaphthalen-2-yl)fluorene;ethane (PubChem CID 145302395) has the molecular formula C37H32 and a molecular weight of 476.66 g/mol. Its IUPAC name is 9,9-bis(6-methylnaphthalen-2-yl)fluorene;ethane.

Molecular Properties

Compound Name9,9-bis(6-methylnaphthalen-2-yl)fluorene;ethane
PubChem CID145302395
Molecular FormulaC37H32
Molecular Weight476.66 g/mol
Exact Mass476.25
IUPAC Name9,9-bis(6-methylnaphthalen-2-yl)fluorene;ethane
SMILESCC.Cc1ccc2cc(C3(c4ccc5cc(C)ccc5c4)c4ccccc4-c4ccccc43)ccc2c1
InChIInChI=1S/C35H26.C2H6/c1-23-11-13-27-21-29(17-15-25(27)19-23)35(30-18-16-26-20-24(2)12-14-28(26)22-30)33-9-5-3-7-31(33)32-8-4-6-10-34(32)35;1-2/h3-22H,1-2H3;1-2H3
InChIKeyPUWBRUGTPNLFEA-UHFFFAOYSA-N
XLogP10.00
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms37
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500476.66
LogP ≤ 510.00
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

2-(9-anthracen-2-ylfluoren-9-yl)anthracene
CID 162705610
9,9-bis(4-methylphenyl)fluorene;1,7-dimethylnaphthalene;2,3-dimethylnaphthalene;2,7-dimethylnaphthalene
CID 160966642
6,6,12,12-tetrakis(4-methylphenyl)indeno[1,2-b]fluorene
CID 101421308
9,9-bis(6-ethoxynaphthalen-2-yl)fluorene
CID 166857178
11-(6,7-dimethylnaphthalen-2-yl)-11-[4-[4-[9-(6,7-dimethylnaphthalen-2-yl)fluoren-9-yl]phenyl]phenyl]benzo[b]fluorene
CID 164808737
9,9-bis(4-methylphenyl)fluorene;propane
CID 144938703
methane;2-methyl-9,9-diphenylfluorene
CID 144583572
2,2',7'-trimethyl-9,9'-spirobi[fluorene]
CID 20807057
6-[9-(6-hydroxynaphthalen-2-yl)-2,7-dimethylfluoren-9-yl]naphthalen-2-ol
CID 163275915
2,9,9-trinaphthalen-2-ylfluorene
CID 144772576
8-(9-benzo[b]oxanthren-8-ylfluoren-9-yl)benzo[b]oxanthrene
CID 164928731
9,9-bis(4-methoxyphenyl)fluorene;ethane
CID 159536685

Frequently Asked Questions

What is the IUPAC name of 9,9-bis(6-methylnaphthalen-2-yl)fluorene;ethane?
The IUPAC name of 9,9-bis(6-methylnaphthalen-2-yl)fluorene;ethane (CID 145302395) is 9,9-bis(6-methylnaphthalen-2-yl)fluorene;ethane.
What is the SMILES notation for 9,9-bis(6-methylnaphthalen-2-yl)fluorene;ethane?
The canonical SMILES for 9,9-bis(6-methylnaphthalen-2-yl)fluorene;ethane is CC.Cc1ccc2cc(C3(c4ccc5cc(C)ccc5c4)c4ccccc4-c4ccccc43)ccc2c1.
What is the InChIKey of 9,9-bis(6-methylnaphthalen-2-yl)fluorene;ethane?
The InChIKey is PUWBRUGTPNLFEA-UHFFFAOYSA-N. The full InChI is InChI=1S/C35H26.C2H6/c1-23-11-13-27-21-29(17-15-25(27)19-23)35(30-18-16-26-20-24(2)12-14-28(26)22-30)33-9-5-3-7-31(33)32-8-4-6-10-34(32)35;1-2/h3-22H,1-2H3;1-2H3.
What are the key properties of 9,9-bis(6-methylnaphthalen-2-yl)fluorene;ethane?
9,9-bis(6-methylnaphthalen-2-yl)fluorene;ethane has a molecular weight of 476.66 g/mol, XLogP of 10.00, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 9,9-bis(6-methylnaphthalen-2-yl)fluorene;ethane is sourced from PubChem (CID 145302395), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).