10-tert-butylnaphtho[2,3-b][1]benzofuran

C20H18O — CID 164787377

IUPAC10-tert-butylnaphtho[2,3-b][1]benzofuran
SMILESCC(C)(C)c1cccc2cc3oc4ccccc4c3cc12
InChIInChI=1S/C20H18O/c1-20(2,3)17-9-6-7-13-11-19-16(12-15(13)17)14-8-4-5-10-18(14)21-19/h4-12H,1-3H3
InChIKeyZJHFPGJBZQDXQD-UHFFFAOYSA-N
MW274.36 g/mol
LogP6.04
Rot. Bonds

About 10-tert-butylnaphtho[2,3-b][1]benzofuran

10-tert-butylnaphtho[2,3-b][1]benzofuran (PubChem CID 164787377) has the molecular formula C20H18O and a molecular weight of 274.36 g/mol. Its IUPAC name is 10-tert-butylnaphtho[2,3-b][1]benzofuran.

Molecular Properties

Compound Name10-tert-butylnaphtho[2,3-b][1]benzofuran
PubChem CID164787377
Molecular FormulaC20H18O
Molecular Weight274.36 g/mol
Exact Mass274.14
IUPAC Name10-tert-butylnaphtho[2,3-b][1]benzofuran
SMILESCC(C)(C)c1cccc2cc3oc4ccccc4c3cc12
InChIInChI=1S/C20H18O/c1-20(2,3)17-9-6-7-13-11-19-16(12-15(13)17)14-8-4-5-10-18(14)21-19/h4-12H,1-3H3
InChIKeyZJHFPGJBZQDXQD-UHFFFAOYSA-N
XLogP6.04
TPSA13.14 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500274.36
LogP ≤ 56.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

1-tert-butyldibenzofuran
CID 59078665
12,22-dioxahexacyclo[11.11.0.02,11.04,9.015,23.016,21]tetracosa-1(13),2,4,6,8,10,14,16,18,20,23-undecaene
CID 118151066
10-(trifluoromethyl)benzo[b]xanthen-12-one
CID 135167546
9-tert-butylnaphtho[2,3-b][1]benzofuran
CID 164787408
(2-tert-butyldibenzofuran-3-yl)methanetriol
CID 163858130
7-tert-butyl-12,22-dioxahexacyclo[11.11.0.02,11.04,9.015,23.016,21]tetracosa-1(13),2(11),3,5,7,9,14,16,18,20,23-undecaene
CID 118153211
9,16-dioxahexacyclo[11.11.0.02,10.03,8.015,23.017,22]tetracosa-1(24),2(10),3,5,7,11,13,15(23),17,19,21-undecaene
CID 126718289
10,20-dioxapentacyclo[11.7.0.03,11.04,9.014,19]icosa-1(13),2,4,6,8,11,14,16,18-nonaene;ethane
CID 154692122
26-oxa-1-azaoctacyclo[14.13.1.02,11.04,9.012,30.017,29.019,27.020,25]triaconta-2,4,6,8,10,12(30),13,15,17(29),18,20,22,24,27-tetradecaene
CID 146376243
8-anthracen-9-yl-10,14-dioxapentacyclo[11.7.0.03,11.04,9.015,20]icosa-1,3(11),4(9),5,7,12,15,17,19-nonaene
CID 170654328
ethane;naphtho[2,1-b][1]benzofuran;naphtho[2,3-b][1]benzofuran
CID 142369862
2-(3-aminodibenzofuran-2-yl)propan-2-ol
CID 170318792

Frequently Asked Questions

What is the IUPAC name of 10-tert-butylnaphtho[2,3-b][1]benzofuran?
The IUPAC name of 10-tert-butylnaphtho[2,3-b][1]benzofuran (CID 164787377) is 10-tert-butylnaphtho[2,3-b][1]benzofuran.
What is the SMILES notation for 10-tert-butylnaphtho[2,3-b][1]benzofuran?
The canonical SMILES for 10-tert-butylnaphtho[2,3-b][1]benzofuran is CC(C)(C)c1cccc2cc3oc4ccccc4c3cc12.
What is the InChIKey of 10-tert-butylnaphtho[2,3-b][1]benzofuran?
The InChIKey is ZJHFPGJBZQDXQD-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H18O/c1-20(2,3)17-9-6-7-13-11-19-16(12-15(13)17)14-8-4-5-10-18(14)21-19/h4-12H,1-3H3.
What are the key properties of 10-tert-butylnaphtho[2,3-b][1]benzofuran?
10-tert-butylnaphtho[2,3-b][1]benzofuran has a molecular weight of 274.36 g/mol, XLogP of 6.04, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 10-tert-butylnaphtho[2,3-b][1]benzofuran is sourced from PubChem (CID 164787377), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).