7,7-dimethyl-10-propan-2-ylbenzo[c]fluorene

C22H22 — CID 140704515

IUPAC7,7-dimethyl-10-propan-2-ylbenzo[c]fluorene
SMILESCC(C)c1ccc2c(c1)-c1c(ccc3ccccc13)C2(C)C
InChIInChI=1S/C22H22/c1-14(2)16-10-11-19-18(13-16)21-17-8-6-5-7-15(17)9-12-20(21)22(19,3)4/h5-14H,1-4H3
InChIKeyDJZGETAPIUTRHD-UHFFFAOYSA-N
MW286.42 g/mol
LogP6.27
Rot. Bonds1

About 7,7-dimethyl-10-propan-2-ylbenzo[c]fluorene

7,7-dimethyl-10-propan-2-ylbenzo[c]fluorene (PubChem CID 140704515) has the molecular formula C22H22 and a molecular weight of 286.42 g/mol. Its IUPAC name is 7,7-dimethyl-10-propan-2-ylbenzo[c]fluorene.

Molecular Properties

Compound Name7,7-dimethyl-10-propan-2-ylbenzo[c]fluorene
PubChem CID140704515
Molecular FormulaC22H22
Molecular Weight286.42 g/mol
Exact Mass286.17
IUPAC Name7,7-dimethyl-10-propan-2-ylbenzo[c]fluorene
SMILESCC(C)c1ccc2c(c1)-c1c(ccc3ccccc13)C2(C)C
InChIInChI=1S/C22H22/c1-14(2)16-10-11-19-18(13-16)21-17-8-6-5-7-15(17)9-12-20(21)22(19,3)4/h5-14H,1-4H3
InChIKeyDJZGETAPIUTRHD-UHFFFAOYSA-N
XLogP6.27
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500286.42
LogP ≤ 56.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

7,7-dimethyl-N-(4-propan-2-ylphenyl)benzo[g]fluoren-9-amine
CID 142714289
7,7-dimethylbenzo[c]fluorene;hydroiodide
CID 144938625
7,7-dimethylbenzo[c]fluorene;ethane
CID 90712910
25,25-dimethylhexacyclo[12.11.0.03,12.04,9.015,24.016,21]pentacosa-1(14),2,4,6,8,10,12,15(24),16,18,20,22-dodecaene
CID 59742057
5,5,19,19-tetramethylnonacyclo[18.16.0.02,18.04,16.06,15.09,14.023,36.024,33.025,30]hexatriaconta-1(20),2(18),3,6(15),7,9,11,13,16,21,23(36),24(33),25,27,29,31,34-heptadecaene
CID 58261583
12,12-dimethylpentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene;ethene
CID 91481070
7,7-dimethyl-10-[4-(10-naphthalen-2-ylanthracen-9-yl)phenyl]benzo[c]fluorene;7,7-dimethyl-10-[4-(10-phenylanthracen-9-yl)phenyl]benzo[c]fluorene
CID 157086899
7,7-dimethylbenzo[g]fluoren-9-amine
CID 90277897
5,5,19,19,33,33-hexamethyl-19λ4-thianonacyclo[18.15.0.02,18.04,16.06,15.09,14.022,34.023,32.024,29]pentatriaconta-1(35),2,4(16),6(15),7,9,11,13,17,20,22(34),23(32),24,26,28,30-hexadecaene
CID 146356929
7,7-dimethyl-10-[4-(10-naphthalen-1-ylanthracen-9-yl)naphthalen-1-yl]benzo[c]fluorene
CID 162108873
7,7-dimethyl-10-[10-(3-naphthalen-1-ylphenyl)anthracen-9-yl]benzo[c]fluorene
CID 140724252
8-tert-butyl-7,7-dimethylbenzo[c]fluorene;9-tert-butyl-7,7-dimethylbenzo[c]fluorene;10-tert-butyl-7,7-dimethylbenzo[c]fluorene;11,11-dimethyl-1-propan-2-ylbenzo[b]fluorene;11,11-dimethyl-2-propan-2-ylbenzo[b]fluorene;11,11-dimethyl-3-propan-2-ylbenzo[b]fluorene;11,11-dimethyl-4-propan-2-ylbenzo[b]fluorene
CID 159909633

Frequently Asked Questions

What is the IUPAC name of 7,7-dimethyl-10-propan-2-ylbenzo[c]fluorene?
The IUPAC name of 7,7-dimethyl-10-propan-2-ylbenzo[c]fluorene (CID 140704515) is 7,7-dimethyl-10-propan-2-ylbenzo[c]fluorene.
What is the SMILES notation for 7,7-dimethyl-10-propan-2-ylbenzo[c]fluorene?
The canonical SMILES for 7,7-dimethyl-10-propan-2-ylbenzo[c]fluorene is CC(C)c1ccc2c(c1)-c1c(ccc3ccccc13)C2(C)C.
What is the InChIKey of 7,7-dimethyl-10-propan-2-ylbenzo[c]fluorene?
The InChIKey is DJZGETAPIUTRHD-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H22/c1-14(2)16-10-11-19-18(13-16)21-17-8-6-5-7-15(17)9-12-20(21)22(19,3)4/h5-14H,1-4H3.
What are the key properties of 7,7-dimethyl-10-propan-2-ylbenzo[c]fluorene?
7,7-dimethyl-10-propan-2-ylbenzo[c]fluorene has a molecular weight of 286.42 g/mol, XLogP of 6.27, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 7,7-dimethyl-10-propan-2-ylbenzo[c]fluorene is sourced from PubChem (CID 140704515), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).