6-bromospiro[1,2-dihydroindene-3,1'-cyclopropane];ethane

C15H23Br — CID 145339117

IUPAC6-bromospiro[1,2-dihydroindene-3,1'-cyclopropane];ethane
SMILESBrc1ccc2c(c1)CCC21CC1.CC.CC
InChIInChI=1S/C11H11Br.2C2H6/c12-9-1-2-10-8(7-9)3-4-11(10)5-6-11;2*1-2/h1-2,7H,3-6H2;2*1-2H3
InChIKeyDKIPIGROGVAZHN-UHFFFAOYSA-N
MW283.25 g/mol
LogP5.48
Rot. Bonds

About 6-bromospiro[1,2-dihydroindene-3,1'-cyclopropane];ethane

6-bromospiro[1,2-dihydroindene-3,1'-cyclopropane];ethane (PubChem CID 145339117) has the molecular formula C15H23Br and a molecular weight of 283.25 g/mol. Its IUPAC name is 6-bromospiro[1,2-dihydroindene-3,1'-cyclopropane];ethane.

Molecular Properties

Compound Name6-bromospiro[1,2-dihydroindene-3,1'-cyclopropane];ethane
PubChem CID145339117
Molecular FormulaC15H23Br
Molecular Weight283.25 g/mol
Exact Mass282.10
IUPAC Name6-bromospiro[1,2-dihydroindene-3,1'-cyclopropane];ethane
SMILESBrc1ccc2c(c1)CCC21CC1.CC.CC
InChIInChI=1S/C11H11Br.2C2H6/c12-9-1-2-10-8(7-9)3-4-11(10)5-6-11;2*1-2/h1-2,7H,3-6H2;2*1-2H3
InChIKeyDKIPIGROGVAZHN-UHFFFAOYSA-N
XLogP5.48
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms16
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500283.25
LogP ≤ 55.48
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

7-bromo-3,3,4,4-tetramethyl-1,2-dihydronaphthalene
CID 175335793
6-bromo-3,3-dimethyl-2,4-dihydro-1H-naphthalene
CID 144794657
[5-bromo-1-(dimethylamino)-2,3-dihydroinden-1-yl]methanol;ethane
CID 142460110
7-bromospiro[2,3-dihydro-1H-isoquinoline-4,1'-cyclopropane];hydrochloride
CID 155820090
(4R)-7-bromospiro[2,3-dihydro-1H-naphthalene-4,3'-pyrrolidine]
CID 129384980
5-bromospiro[1,2-dihydroindene-3,4'-piperidine]
CID 83671316
6-bromo-2'-propan-2-ylspiro[1,2-dihydroindene-3,1'-cyclopropane]
CID 167091801
7-bromo-4-methoxy-4-methyl-2,3-dihydro-1H-naphthalene
CID 118326661
5-bromo-1-[bromo(difluoro)methyl]-2,3-dihydroinden-1-ol
CID 107140447
6-bromo-1,1-dimethyl-3,4-dihydroisochromene
CID 139328426
(1'R,3R)-6-bromospiro[1,2-dihydroindene-3,2'-cyclopropane]-1'-amine
CID 124572230
(1'S)-6-bromospiro[1,2-dihydroindene-3,2'-cyclopropane]-1'-amine
CID 129284661

Frequently Asked Questions

What is the IUPAC name of 6-bromospiro[1,2-dihydroindene-3,1'-cyclopropane];ethane?
The IUPAC name of 6-bromospiro[1,2-dihydroindene-3,1'-cyclopropane];ethane (CID 145339117) is 6-bromospiro[1,2-dihydroindene-3,1'-cyclopropane];ethane.
What is the SMILES notation for 6-bromospiro[1,2-dihydroindene-3,1'-cyclopropane];ethane?
The canonical SMILES for 6-bromospiro[1,2-dihydroindene-3,1'-cyclopropane];ethane is Brc1ccc2c(c1)CCC21CC1.CC.CC.
What is the InChIKey of 6-bromospiro[1,2-dihydroindene-3,1'-cyclopropane];ethane?
The InChIKey is DKIPIGROGVAZHN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11Br.2C2H6/c12-9-1-2-10-8(7-9)3-4-11(10)5-6-11;2*1-2/h1-2,7H,3-6H2;2*1-2H3.
What are the key properties of 6-bromospiro[1,2-dihydroindene-3,1'-cyclopropane];ethane?
6-bromospiro[1,2-dihydroindene-3,1'-cyclopropane];ethane has a molecular weight of 283.25 g/mol, XLogP of 5.48, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 6-bromospiro[1,2-dihydroindene-3,1'-cyclopropane];ethane is sourced from PubChem (CID 145339117), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).