[3-phenyl-1-(3-phenyl-5,6,7,8-tetrahydronaphthalen-1-yl)-5,6,7,8-tetrahydronaphthalen-2-yl] hypofluorite

C32H29FO — CID 142141369

IUPAC[3-phenyl-1-(3-phenyl-5,6,7,8-tetrahydronaphthalen-1-yl)-5,6,7,8-tetrahydronaphthalen-2-yl] hypofluorite
SMILESFOc1c(-c2ccccc2)cc2c(c1-c1cc(-c3ccccc3)cc3c1CCCC3)CCCC2
InChIInChI=1S/C32H29FO/c33-34-32-29(23-13-5-2-6-14-23)20-25-16-8-10-18-28(25)31(32)30-21-26(22-11-3-1-4-12-22)19-24-15-7-9-17-27(24)30/h1-6,11-14,19-21H,7-10,15-18H2
InChIKeyGHJKBAUGFYTBES-UHFFFAOYSA-N
MW448.58 g/mol
LogP8.71
Rot. Bonds4

About [3-phenyl-1-(3-phenyl-5,6,7,8-tetrahydronaphthalen-1-yl)-5,6,7,8-tetrahydronaphthalen-2-yl] hypofluorite

[3-phenyl-1-(3-phenyl-5,6,7,8-tetrahydronaphthalen-1-yl)-5,6,7,8-tetrahydronaphthalen-2-yl] hypofluorite (PubChem CID 142141369) has the molecular formula C32H29FO and a molecular weight of 448.58 g/mol. Its IUPAC name is [3-phenyl-1-(3-phenyl-5,6,7,8-tetrahydronaphthalen-1-yl)-5,6,7,8-tetrahydronaphthalen-2-yl] hypofluorite.

Molecular Properties

Compound Name[3-phenyl-1-(3-phenyl-5,6,7,8-tetrahydronaphthalen-1-yl)-5,6,7,8-tetrahydronaphthalen-2-yl] hypofluorite
PubChem CID142141369
Molecular FormulaC32H29FO
Molecular Weight448.58 g/mol
Exact Mass448.22
IUPAC Name[3-phenyl-1-(3-phenyl-5,6,7,8-tetrahydronaphthalen-1-yl)-5,6,7,8-tetrahydronaphthalen-2-yl] hypofluorite
SMILESFOc1c(-c2ccccc2)cc2c(c1-c1cc(-c3ccccc3)cc3c1CCCC3)CCCC2
InChIInChI=1S/C32H29FO/c33-34-32-29(23-13-5-2-6-14-23)20-25-16-8-10-18-28(25)31(32)30-21-26(22-11-3-1-4-12-22)19-24-15-7-9-17-27(24)30/h1-6,11-14,19-21H,7-10,15-18H2
InChIKeyGHJKBAUGFYTBES-UHFFFAOYSA-N
XLogP8.71
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms34
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500448.58
LogP ≤ 58.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

5-methyl-6,7-diphenyl-1,2,3,4-tetrahydronaphthalene
CID 170671649
N-[anilino-[1-(2-dianilinophosphanyl-3-phenyl-5,6,7,8-tetrahydronaphthalen-1-yl)-3-phenyl-5,6,7,8-tetrahydronaphthalen-2-yl]phosphanyl]aniline
CID 20606219
1-(2-amino-5,6,7,8-tetrahydronaphthalen-1-yl)-3-phenyl-5,6,7,8-tetrahydronaphthalen-2-amine
CID 175057445
4-phenyl-1,2-dihydrocyclobuta[a]naphthalene
CID 163649392
2-(7-phenylnaphthalen-1-yl)-4-(4-phenylphenyl)-6-[4-(1,2,3,4-tetrahydrophenanthren-9-yl)phenyl]-1,3,5-triazine
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1,1,1-trifluoro-N-[13-oxo-10,16-bis(4-phenylphenyl)-12,14-dioxa-13λ5-phosphapentacyclo[13.8.0.02,11.03,8.018,23]tricosa-1(23),2,8,10,15,17-hexaen-13-yl]methanesulfonamide
CID 102260622
dicyclohexyl-[[1-[2-(dicyclohexylphosphanylmethyl)-3-phenyl-5,6,7,8-tetrahydronaphthalen-1-yl]-3-phenyl-5,6,7,8-tetrahydronaphthalen-2-yl]methyl]phosphane
CID 20606212
2,4,8,10-tetramethyl-6-[3-phenyl-1-[3-phenyl-2-(2,4,8,10-tetramethylbenzo[d][1,3,2]benzodioxaphosphepin-6-yl)-5,6,7,8-tetrahydronaphthalen-1-yl]-5,6,7,8-tetrahydronaphthalen-2-yl]benzo[d][1,3,2]benzodioxaphosphepine
CID 20758584
7-[3,5-bis(trifluoromethyl)phenyl]-5-[3-[3,5-bis(trifluoromethyl)phenyl]-5,6,7,8-tetrahydronaphthalen-1-yl]-1,2,3,4-tetrahydronaphthalene
CID 175883342
6,7-dimethoxy-9,10-diphenyl-1,2,3,4-tetrahydroanthracene
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13-[1-[2-(12,14-dioxa-13-phosphapentacyclo[13.8.0.02,11.03,8.018,23]tricosa-1(15),2(11),3,5,7,9,16,18,20,22-decaen-13-yl)-3-phenyl-5,6,7,8-tetrahydronaphthalen-1-yl]-3-phenyl-5,6,7,8-tetrahydronaphthalen-2-yl]-12,14-dioxa-13-phosphapentacyclo[13.8.0.02,11.03,8.018,23]tricosa-1(15),2(11),3,5,7,9,16,18,20,22-decaene
CID 20758576
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Frequently Asked Questions

What is the IUPAC name of [3-phenyl-1-(3-phenyl-5,6,7,8-tetrahydronaphthalen-1-yl)-5,6,7,8-tetrahydronaphthalen-2-yl] hypofluorite?
The IUPAC name of [3-phenyl-1-(3-phenyl-5,6,7,8-tetrahydronaphthalen-1-yl)-5,6,7,8-tetrahydronaphthalen-2-yl] hypofluorite (CID 142141369) is [3-phenyl-1-(3-phenyl-5,6,7,8-tetrahydronaphthalen-1-yl)-5,6,7,8-tetrahydronaphthalen-2-yl] hypofluorite.
What is the SMILES notation for [3-phenyl-1-(3-phenyl-5,6,7,8-tetrahydronaphthalen-1-yl)-5,6,7,8-tetrahydronaphthalen-2-yl] hypofluorite?
The canonical SMILES for [3-phenyl-1-(3-phenyl-5,6,7,8-tetrahydronaphthalen-1-yl)-5,6,7,8-tetrahydronaphthalen-2-yl] hypofluorite is FOc1c(-c2ccccc2)cc2c(c1-c1cc(-c3ccccc3)cc3c1CCCC3)CCCC2.
What is the InChIKey of [3-phenyl-1-(3-phenyl-5,6,7,8-tetrahydronaphthalen-1-yl)-5,6,7,8-tetrahydronaphthalen-2-yl] hypofluorite?
The InChIKey is GHJKBAUGFYTBES-UHFFFAOYSA-N. The full InChI is InChI=1S/C32H29FO/c33-34-32-29(23-13-5-2-6-14-23)20-25-16-8-10-18-28(25)31(32)30-21-26(22-11-3-1-4-12-22)19-24-15-7-9-17-27(24)30/h1-6,11-14,19-21H,7-10,15-18H2.
What are the key properties of [3-phenyl-1-(3-phenyl-5,6,7,8-tetrahydronaphthalen-1-yl)-5,6,7,8-tetrahydronaphthalen-2-yl] hypofluorite?
[3-phenyl-1-(3-phenyl-5,6,7,8-tetrahydronaphthalen-1-yl)-5,6,7,8-tetrahydronaphthalen-2-yl] hypofluorite has a molecular weight of 448.58 g/mol, XLogP of 8.71, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [3-phenyl-1-(3-phenyl-5,6,7,8-tetrahydronaphthalen-1-yl)-5,6,7,8-tetrahydronaphthalen-2-yl] hypofluorite is sourced from PubChem (CID 142141369), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).