10-iodo-9-phenyl-4a,10-dihydroanthracene

C20H15I — CID 129174339

IUPAC10-iodo-9-phenyl-4a,10-dihydroanthracene
SMILESIC1c2ccccc2C(c2ccccc2)=C2C=CC=CC21
InChIInChI=1S/C20H15I/c21-20-17-12-6-4-10-15(17)19(14-8-2-1-3-9-14)16-11-5-7-13-18(16)20/h1-13,17,20H
InChIKeyUHEBFYJSGNQDME-UHFFFAOYSA-N
MW382.24 g/mol
LogP5.72
Rot. Bonds1

About 10-iodo-9-phenyl-4a,10-dihydroanthracene

10-iodo-9-phenyl-4a,10-dihydroanthracene (PubChem CID 129174339) has the molecular formula C20H15I and a molecular weight of 382.24 g/mol. Its IUPAC name is 10-iodo-9-phenyl-4a,10-dihydroanthracene.

Molecular Properties

Compound Name10-iodo-9-phenyl-4a,10-dihydroanthracene
PubChem CID129174339
Molecular FormulaC20H15I
Molecular Weight382.24 g/mol
Exact Mass382.02
IUPAC Name10-iodo-9-phenyl-4a,10-dihydroanthracene
SMILESIC1c2ccccc2C(c2ccccc2)=C2C=CC=CC21
InChIInChI=1S/C20H15I/c21-20-17-12-6-4-10-15(17)19(14-8-2-1-3-9-14)16-11-5-7-13-18(16)20/h1-13,17,20H
InChIKeyUHEBFYJSGNQDME-UHFFFAOYSA-N
XLogP5.72
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500382.24
LogP ≤ 55.72
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

2-[10-(2-phenylphenyl)-8a,9-dihydroanthracen-9-yl]naphtho[2,3-b][1]benzofuran
CID 174292735
5-chrysen-6-yl-2-(10-phenyl-8a,9-dihydroanthracen-9-yl)pyridine
CID 88943692
7-[10-(2-phenylphenyl)-4a,10-dihydroanthracen-9-yl]naphtho[1,2-b][1]benzofuran
CID 167515975
N-[3-(3-bicyclo[4.2.0]octa-1(6),2,4-trienyl)phenyl]-N-methyl-3-[10-(3-methylphenyl)-8a,9-dihydroanthracen-9-yl]aniline
CID 129282050
5-(10-dibenzofuran-1-yl-8a,9-dihydroanthracen-9-yl)-9,14-dioxapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3(8),4,6,11,15,17,19-nonaene
CID 174288377
ethyl 4-(4aH-fluoren-9-yl)benzoate
CID 67613234
9-phenyl-1-[5-[10-(4-phenylphenyl)-4a,10-dihydroanthracen-9-yl]-2-pyridinyl]carbazole
CID 134531032
2-chloro-1-methyl-3-phenyl-1H-indene
CID 13149961
9-propan-2-yl-4aH-fluorene
CID 59892983
9-[4-(8,9-dihydro-7H-benzo[7]annulen-1-yl)phenyl]-10-naphthalen-2-yl-4a,10-dihydroanthracene
CID 143168382
2-cyclopenta-2,4-dien-1-yl-6-phenylphenol
CID 141440558
7-phenyl-2,2a-dihydro-1H-cyclobuta[a]indene
CID 90884899

Frequently Asked Questions

What is the IUPAC name of 10-iodo-9-phenyl-4a,10-dihydroanthracene?
The IUPAC name of 10-iodo-9-phenyl-4a,10-dihydroanthracene (CID 129174339) is 10-iodo-9-phenyl-4a,10-dihydroanthracene.
What is the SMILES notation for 10-iodo-9-phenyl-4a,10-dihydroanthracene?
The canonical SMILES for 10-iodo-9-phenyl-4a,10-dihydroanthracene is IC1c2ccccc2C(c2ccccc2)=C2C=CC=CC21.
What is the InChIKey of 10-iodo-9-phenyl-4a,10-dihydroanthracene?
The InChIKey is UHEBFYJSGNQDME-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H15I/c21-20-17-12-6-4-10-15(17)19(14-8-2-1-3-9-14)16-11-5-7-13-18(16)20/h1-13,17,20H.
What are the key properties of 10-iodo-9-phenyl-4a,10-dihydroanthracene?
10-iodo-9-phenyl-4a,10-dihydroanthracene has a molecular weight of 382.24 g/mol, XLogP of 5.72, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 10-iodo-9-phenyl-4a,10-dihydroanthracene is sourced from PubChem (CID 129174339), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).