6-propan-2-ylfuro[2,3-f][1,3]benzodioxole

C12H12O3 — CID 146176687

IUPAC6-propan-2-ylfuro[2,3-f][1,3]benzodioxole
SMILESCC(C)c1cc2cc3c(cc2o1)OCO3
InChIInChI=1S/C12H12O3/c1-7(2)9-3-8-4-11-12(14-6-13-11)5-10(8)15-9/h3-5,7H,6H2,1-2H3
InChIKeyDUUGHEVJFZLPCZ-UHFFFAOYSA-N
MW204.22 g/mol
LogP3.28
Rot. Bonds1

About 6-propan-2-ylfuro[2,3-f][1,3]benzodioxole

6-propan-2-ylfuro[2,3-f][1,3]benzodioxole (PubChem CID 146176687) has the molecular formula C12H12O3 and a molecular weight of 204.22 g/mol. Its IUPAC name is 6-propan-2-ylfuro[2,3-f][1,3]benzodioxole.

Molecular Properties

Compound Name6-propan-2-ylfuro[2,3-f][1,3]benzodioxole
PubChem CID146176687
Molecular FormulaC12H12O3
Molecular Weight204.22 g/mol
Exact Mass204.08
IUPAC Name6-propan-2-ylfuro[2,3-f][1,3]benzodioxole
SMILESCC(C)c1cc2cc3c(cc2o1)OCO3
InChIInChI=1S/C12H12O3/c1-7(2)9-3-8-4-11-12(14-6-13-11)5-10(8)15-9/h3-5,7H,6H2,1-2H3
InChIKeyDUUGHEVJFZLPCZ-UHFFFAOYSA-N
XLogP3.28
TPSA31.60 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.22
LogP ≤ 53.28
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

N-methylfuro[2,3-f][1,3]benzodioxole-6-carboxamide
CID 139623375
6-ethyl-2-propan-2-ylfuro[3,2-f][1]benzofuran
CID 70831990
furo[2,3-f][1,3]benzodioxol-6-yl-(4-methylphenyl)methanone
CID 60587967
2-propan-2-ylfuro[3,2-c]pyridine
CID 20602980
4-(furo[2,3-f][1,3]benzodioxol-6-ylmethyl)phenol
CID 123388809
(2,5-dimethylphenyl)-furo[2,3-f][1,3]benzodioxol-6-ylmethanone
CID 60587952
6-bromo-7-propan-2-yl-[1,3]dioxolo[4,5-g]quinoline
CID 39403172
3-(dimethylamino)propyl furo[2,3-f][1,3]benzodioxole-6-carboxylate
CID 71577026
4,5,10,11-tetramethyl-19,21-dioxahexacyclo[12.11.0.02,7.08,13.016,24.018,22]pentacosa-1,3,5,7,9,11,13,15,17,22,24-undecaene
CID 11773352
2-propan-2-yl-6,7-dihydro-[1,4]dioxino[2,3-f][1,3]benzoxazole
CID 82230850
1,3-benzodioxol-5-yl-(5-fluoro-1-benzofuran-2-yl)methanamine
CID 107699812
6-methyl-N-propan-2-yl-1,3-benzodioxol-5-amine
CID 83698244

Frequently Asked Questions

What is the IUPAC name of 6-propan-2-ylfuro[2,3-f][1,3]benzodioxole?
The IUPAC name of 6-propan-2-ylfuro[2,3-f][1,3]benzodioxole (CID 146176687) is 6-propan-2-ylfuro[2,3-f][1,3]benzodioxole.
What is the SMILES notation for 6-propan-2-ylfuro[2,3-f][1,3]benzodioxole?
The canonical SMILES for 6-propan-2-ylfuro[2,3-f][1,3]benzodioxole is CC(C)c1cc2cc3c(cc2o1)OCO3.
What is the InChIKey of 6-propan-2-ylfuro[2,3-f][1,3]benzodioxole?
The InChIKey is DUUGHEVJFZLPCZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12O3/c1-7(2)9-3-8-4-11-12(14-6-13-11)5-10(8)15-9/h3-5,7H,6H2,1-2H3.
What are the key properties of 6-propan-2-ylfuro[2,3-f][1,3]benzodioxole?
6-propan-2-ylfuro[2,3-f][1,3]benzodioxole has a molecular weight of 204.22 g/mol, XLogP of 3.28, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-propan-2-ylfuro[2,3-f][1,3]benzodioxole is sourced from PubChem (CID 146176687), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).