7,7-dideuteriobenzo[c]fluorene

C17H12 — CID 90482120

IUPAC7,7-dideuteriobenzo[c]fluorene
SMILES[2H]C1([2H])c2ccccc2-c2c1ccc1ccccc21
InChIInChI=1S/C17H12/c1-3-7-15-12(5-1)9-10-14-11-13-6-2-4-8-16(13)17(14)15/h1-10H,11H2/i11D2
InChIKeyFRIJWEQBTIZQMD-ZWGOZCLVSA-N
MW218.30 g/mol
LogP4.41
Rot. Bonds

About 7,7-dideuteriobenzo[c]fluorene

7,7-dideuteriobenzo[c]fluorene (PubChem CID 90482120) has the molecular formula C17H12 and a molecular weight of 218.30 g/mol. Its IUPAC name is 7,7-dideuteriobenzo[c]fluorene.

Molecular Properties

Compound Name7,7-dideuteriobenzo[c]fluorene
PubChem CID90482120
Molecular FormulaC17H12
Molecular Weight218.30 g/mol
Exact Mass218.11
IUPAC Name7,7-dideuteriobenzo[c]fluorene
SMILES[2H]C1([2H])c2ccccc2-c2c1ccc1ccccc21
InChIInChI=1S/C17H12/c1-3-7-15-12(5-1)9-10-14-11-13-6-2-4-8-16(13)17(14)15/h1-10H,11H2/i11D2
InChIKeyFRIJWEQBTIZQMD-ZWGOZCLVSA-N
XLogP4.41
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.30
LogP ≤ 54.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

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9,10-dihydrophenanthrene;phenanthrene
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heptacyclo[16.12.0.02,15.03,12.04,9.021,30.024,29]triaconta-1(18),2(15),3(12),4,6,8,10,16,21(30),22,24,26,28-tridecaene
CID 11954527
nonacyclo[30.8.0.02,11.03,8.012,21.015,20.022,31.023,28.035,40]tetraconta-1(32),2(11),3,5,7,9,12(21),13,15,17,19,22(31),23,25,27,29,33,35,37,39-icosaene
CID 15525083
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CID 100921438
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CID 14940541
undecacyclo[22.18.0.03,22.04,20.06,18.08,17.011,16.025,41.028,40.029,38.030,35]dotetraconta-1(24),2,4(20),5,8(17),9,11,13,15,18,22,25(41),26,28(40),29(38),30,32,34,36-nonadecaene
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9-(10-phenanthren-9-ylanthracen-9-yl)-7H-benzo[c]fluorene
CID 160788776
bis(7,12-dihydroindeno[1,2-a]fluorene);11,12-dihydroindeno[2,1-a]fluorene;6,12-dihydroindeno[1,2-b]fluorene;10,12-dihydroindeno[2,1-b]fluorene;pentacyclo[11.8.0.02,11.03,8.015,20]henicosa-1(21),2(11),3,5,7,9,13,15,17,19-decaene;pentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene
CID 158887137

Frequently Asked Questions

What is the IUPAC name of 7,7-dideuteriobenzo[c]fluorene?
The IUPAC name of 7,7-dideuteriobenzo[c]fluorene (CID 90482120) is 7,7-dideuteriobenzo[c]fluorene.
What is the SMILES notation for 7,7-dideuteriobenzo[c]fluorene?
The canonical SMILES for 7,7-dideuteriobenzo[c]fluorene is [2H]C1([2H])c2ccccc2-c2c1ccc1ccccc21.
What is the InChIKey of 7,7-dideuteriobenzo[c]fluorene?
The InChIKey is FRIJWEQBTIZQMD-ZWGOZCLVSA-N. The full InChI is InChI=1S/C17H12/c1-3-7-15-12(5-1)9-10-14-11-13-6-2-4-8-16(13)17(14)15/h1-10H,11H2/i11D2.
What are the key properties of 7,7-dideuteriobenzo[c]fluorene?
7,7-dideuteriobenzo[c]fluorene has a molecular weight of 218.30 g/mol, XLogP of 4.41, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 7,7-dideuteriobenzo[c]fluorene is sourced from PubChem (CID 90482120), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).