5-[(3-bromophenyl)methoxy]-2,3-dihydro-1H-indene

C16H15BrO — CID 60645315

IUPAC5-[(3-bromophenyl)methoxy]-2,3-dihydro-1H-indene
SMILESBrc1cccc(COc2ccc3c(c2)CCC3)c1
InChIInChI=1S/C16H15BrO/c17-15-6-1-3-12(9-15)11-18-16-8-7-13-4-2-5-14(13)10-16/h1,3,6-10H,2,4-5,11H2
InChIKeyTYEUIYZUDBHHIA-UHFFFAOYSA-N
MW303.20 g/mol
LogP4.52
Rot. Bonds3

About 5-[(3-bromophenyl)methoxy]-2,3-dihydro-1H-indene

5-[(3-bromophenyl)methoxy]-2,3-dihydro-1H-indene (PubChem CID 60645315) has the molecular formula C16H15BrO and a molecular weight of 303.20 g/mol. Its IUPAC name is 5-[(3-bromophenyl)methoxy]-2,3-dihydro-1H-indene.

Molecular Properties

Compound Name5-[(3-bromophenyl)methoxy]-2,3-dihydro-1H-indene
PubChem CID60645315
Molecular FormulaC16H15BrO
Molecular Weight303.20 g/mol
Exact Mass302.03
IUPAC Name5-[(3-bromophenyl)methoxy]-2,3-dihydro-1H-indene
SMILESBrc1cccc(COc2ccc3c(c2)CCC3)c1
InChIInChI=1S/C16H15BrO/c17-15-6-1-3-12(9-15)11-18-16-8-7-13-4-2-5-14(13)10-16/h1,3,6-10H,2,4-5,11H2
InChIKeyTYEUIYZUDBHHIA-UHFFFAOYSA-N
XLogP4.52
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.20
LogP ≤ 54.52
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

6-[2-(3-bromophenoxy)ethoxy]-1,2,3,4-tetrahydronaphthalene
CID 63457392
1-[6-[(3-bromophenyl)methoxy]-1,2,3,4-tetrahydronaphthalen-2-yl]-N,N-dimethylmethanamine
CID 18361480
2-bromo-6-[(3-bromophenyl)methoxy]naphthalene
CID 7786828
5-[(2-bromophenyl)methoxy]-2,3-dihydro-1H-indene
CID 60644006
1-(3-bromophenyl)-4-(2,3-dihydro-1H-inden-5-yloxymethyl)triazole
CID 162658624
1-bromo-3-[(4-chlorophenoxy)methyl]benzene
CID 60643956
1-bromo-3-[(4-fluorophenoxy)methyl]benzene
CID 60643983
1-bromo-3-[(4-iodophenoxy)methyl]benzene
CID 60645515
2-[(3-bromophenyl)methoxy]-1-(2,3-dihydro-1H-inden-5-yl)ethanone
CID 82810406
1-bromo-3-[(3-ethylphenoxy)methyl]benzene
CID 60645294
1-bromo-3-[(4-propoxyphenoxy)methyl]benzene
CID 60645272
4-[(3-bromophenyl)methoxy]-2-fluoro-1-methylbenzene
CID 107170182

Frequently Asked Questions

What is the IUPAC name of 5-[(3-bromophenyl)methoxy]-2,3-dihydro-1H-indene?
The IUPAC name of 5-[(3-bromophenyl)methoxy]-2,3-dihydro-1H-indene (CID 60645315) is 5-[(3-bromophenyl)methoxy]-2,3-dihydro-1H-indene.
What is the SMILES notation for 5-[(3-bromophenyl)methoxy]-2,3-dihydro-1H-indene?
The canonical SMILES for 5-[(3-bromophenyl)methoxy]-2,3-dihydro-1H-indene is Brc1cccc(COc2ccc3c(c2)CCC3)c1.
What is the InChIKey of 5-[(3-bromophenyl)methoxy]-2,3-dihydro-1H-indene?
The InChIKey is TYEUIYZUDBHHIA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15BrO/c17-15-6-1-3-12(9-15)11-18-16-8-7-13-4-2-5-14(13)10-16/h1,3,6-10H,2,4-5,11H2.
What are the key properties of 5-[(3-bromophenyl)methoxy]-2,3-dihydro-1H-indene?
5-[(3-bromophenyl)methoxy]-2,3-dihydro-1H-indene has a molecular weight of 303.20 g/mol, XLogP of 4.52, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(3-bromophenyl)methoxy]-2,3-dihydro-1H-indene is sourced from PubChem (CID 60645315), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).