cyclopropyl-(3,5-dibromophenyl)methanone

C10H8Br2O — CID 107976980

IUPACcyclopropyl-(3,5-dibromophenyl)methanone
SMILESO=C(c1cc(Br)cc(Br)c1)C1CC1
InChIInChI=1S/C10H8Br2O/c11-8-3-7(4-9(12)5-8)10(13)6-1-2-6/h3-6H,1-2H2
InChIKeyPNWNMGQNCBLNAY-UHFFFAOYSA-N
MW303.98 g/mol
LogP3.80
Rot. Bonds2

About cyclopropyl-(3,5-dibromophenyl)methanone

cyclopropyl-(3,5-dibromophenyl)methanone (PubChem CID 107976980) has the molecular formula C10H8Br2O and a molecular weight of 303.98 g/mol. Its IUPAC name is cyclopropyl-(3,5-dibromophenyl)methanone.

Molecular Properties

Compound Namecyclopropyl-(3,5-dibromophenyl)methanone
PubChem CID107976980
Molecular FormulaC10H8Br2O
Molecular Weight303.98 g/mol
Exact Mass301.89
IUPAC Namecyclopropyl-(3,5-dibromophenyl)methanone
SMILESO=C(c1cc(Br)cc(Br)c1)C1CC1
InChIInChI=1S/C10H8Br2O/c11-8-3-7(4-9(12)5-8)10(13)6-1-2-6/h3-6H,1-2H2
InChIKeyPNWNMGQNCBLNAY-UHFFFAOYSA-N
XLogP3.80
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.98
LogP ≤ 53.80
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

cyclopentyl-(3,5-dibromophenyl)methanone
CID 107976355
[3-bromo-5-(trifluoromethyl)phenyl]-piperidin-4-ylmethanone
CID 90020499
(3-amino-5-bromophenyl)-(oxolan-3-yl)methanone
CID 116597079
cyclopropyl-(3,4,5-trifluorophenyl)methanone
CID 24724112
(4-bromocyclohexyl)-(4-bromophenyl)methanone
CID 58764697
(3,5-dibromophenyl)-(1,9-dioxaspiro[5.5]undecan-4-yl)methanone
CID 107977143
(4-bromo-3,5-dimethylphenyl)-cyclobutylmethanone
CID 114329540
(3-bromophenyl)-(oxan-4-yl)methanone
CID 63934842
(4-bromo-3,5-dimethylphenyl)-cyclohexylmethanone
CID 114329532
(3,5-dibromobenzoyl) 3,5-dibromobenzoate
CID 101290900
(4-bromophenyl)-cycloheptylmethanone
CID 63492666
cis-(1R,3S)-3-[(3,5-dibromobenzoyl)amino]cyclopentane-1-carboxylic acid
CID 106320556

Frequently Asked Questions

What is the IUPAC name of cyclopropyl-(3,5-dibromophenyl)methanone?
The IUPAC name of cyclopropyl-(3,5-dibromophenyl)methanone (CID 107976980) is cyclopropyl-(3,5-dibromophenyl)methanone.
What is the SMILES notation for cyclopropyl-(3,5-dibromophenyl)methanone?
The canonical SMILES for cyclopropyl-(3,5-dibromophenyl)methanone is O=C(c1cc(Br)cc(Br)c1)C1CC1.
What is the InChIKey of cyclopropyl-(3,5-dibromophenyl)methanone?
The InChIKey is PNWNMGQNCBLNAY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8Br2O/c11-8-3-7(4-9(12)5-8)10(13)6-1-2-6/h3-6H,1-2H2.
What are the key properties of cyclopropyl-(3,5-dibromophenyl)methanone?
cyclopropyl-(3,5-dibromophenyl)methanone has a molecular weight of 303.98 g/mol, XLogP of 3.80, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for cyclopropyl-(3,5-dibromophenyl)methanone is sourced from PubChem (CID 107976980), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).