benzene;1,1'-biphenyl;2,9-dihydro-1H-fluorene;1,2-dihydronaphthalene

C41H38 — CID 157412815

IUPACbenzene;1,1'-biphenyl;2,9-dihydro-1H-fluorene;1,2-dihydronaphthalene
SMILESC1=CC2=C(CC1)Cc1ccccc12.C1=Cc2ccccc2CC1.c1ccc(-c2ccccc2)cc1.c1ccccc1
InChIInChI=1S/C13H12.C12H10.C10H10.C6H6/c1-3-7-12-10(5-1)9-11-6-2-4-8-13(11)12;1-3-7-11(8-4-1)12-9-5-2-6-10-12;1-2-6-10-8-4-3-7-9(10)5-1;1-2-4-6-5-3-1/h1,3-5,7-8H,2,6,9H2;1-10H;1-3,5-7H,4,8H2;1-6H
InChIKeyBOMFQWWDPRXKKD-UHFFFAOYSA-N
MW530.76 g/mol
LogP11.03
Rot. Bonds1

About benzene;1,1'-biphenyl;2,9-dihydro-1H-fluorene;1,2-dihydronaphthalene

benzene;1,1'-biphenyl;2,9-dihydro-1H-fluorene;1,2-dihydronaphthalene (PubChem CID 157412815) has the molecular formula C41H38 and a molecular weight of 530.76 g/mol. Its IUPAC name is benzene;1,1'-biphenyl;2,9-dihydro-1H-fluorene;1,2-dihydronaphthalene.

Molecular Properties

Compound Namebenzene;1,1'-biphenyl;2,9-dihydro-1H-fluorene;1,2-dihydronaphthalene
PubChem CID157412815
Molecular FormulaC41H38
Molecular Weight530.76 g/mol
Exact Mass530.30
IUPAC Namebenzene;1,1'-biphenyl;2,9-dihydro-1H-fluorene;1,2-dihydronaphthalene
SMILESC1=CC2=C(CC1)Cc1ccccc12.C1=Cc2ccccc2CC1.c1ccc(-c2ccccc2)cc1.c1ccccc1
InChIInChI=1S/C13H12.C12H10.C10H10.C6H6/c1-3-7-12-10(5-1)9-11-6-2-4-8-13(11)12;1-3-7-11(8-4-1)12-9-5-2-6-10-12;1-2-6-10-8-4-3-7-9(10)5-1;1-2-4-6-5-3-1/h1,3-5,7-8H,2,6,9H2;1-10H;1-3,5-7H,4,8H2;1-6H
InChIKeyBOMFQWWDPRXKKD-UHFFFAOYSA-N
XLogP11.03
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms41
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500530.76
LogP ≤ 511.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

2,9-dihydro-1H-fluorene;oxolane
CID 175322963
1,2-dihydronaphthalene
CID 161389674
1,2-dihydronaphthalene
CID 9938
2-[4-(8,9-dihydro-7H-fluoren-2-yl)phenyl]-3-[4-(9H-fluoren-2-yl)phenyl]quinoxaline
CID 71106281
bis(1,2-dihydronaphthalene);bis(2,2-dimethylpropane);ethane
CID 159374922
1,2-dihydronaphthalene;phosphoryl trichloride
CID 91096847
1,4-diphenylbenzene;1H-indene
CID 156634731
azulene;1H-indene
CID 160524105
7,8,9,10-tetrahydrobenzo[8]annulene
CID 54518791
N-[4-(5,6-dihydronaphthalen-1-yl)phenyl]-4-phenyl-N-(4-phenylphenyl)aniline
CID 145390533
N-methyl-N-(4-phenylphenyl)-7,8-dihydronaphthalen-2-amine
CID 70877215
1,2-dihydronaphthalene;bis(2,2-dimethylpropane);1H-naphthalen-2-ylidenetungsten
CID 158118772

Frequently Asked Questions

What is the IUPAC name of benzene;1,1'-biphenyl;2,9-dihydro-1H-fluorene;1,2-dihydronaphthalene?
The IUPAC name of benzene;1,1'-biphenyl;2,9-dihydro-1H-fluorene;1,2-dihydronaphthalene (CID 157412815) is benzene;1,1'-biphenyl;2,9-dihydro-1H-fluorene;1,2-dihydronaphthalene.
What is the SMILES notation for benzene;1,1'-biphenyl;2,9-dihydro-1H-fluorene;1,2-dihydronaphthalene?
The canonical SMILES for benzene;1,1'-biphenyl;2,9-dihydro-1H-fluorene;1,2-dihydronaphthalene is C1=CC2=C(CC1)Cc1ccccc12.C1=Cc2ccccc2CC1.c1ccc(-c2ccccc2)cc1.c1ccccc1.
What is the InChIKey of benzene;1,1'-biphenyl;2,9-dihydro-1H-fluorene;1,2-dihydronaphthalene?
The InChIKey is BOMFQWWDPRXKKD-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H12.C12H10.C10H10.C6H6/c1-3-7-12-10(5-1)9-11-6-2-4-8-13(11)12;1-3-7-11(8-4-1)12-9-5-2-6-10-12;1-2-6-10-8-4-3-7-9(10)5-1;1-2-4-6-5-3-1/h1,3-5,7-8H,2,6,9H2;1-10H;1-3,5-7H,4,8H2;1-6H.
What are the key properties of benzene;1,1'-biphenyl;2,9-dihydro-1H-fluorene;1,2-dihydronaphthalene?
benzene;1,1'-biphenyl;2,9-dihydro-1H-fluorene;1,2-dihydronaphthalene has a molecular weight of 530.76 g/mol, XLogP of 11.03, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for benzene;1,1'-biphenyl;2,9-dihydro-1H-fluorene;1,2-dihydronaphthalene is sourced from PubChem (CID 157412815), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).