1-[(2-bromophenyl)methyl]cyclopropan-1-ol

C10H11BrO — CID 84690944

IUPAC1-[(2-bromophenyl)methyl]cyclopropan-1-ol
SMILESOC1(Cc2ccccc2Br)CC1
InChIInChI=1S/C10H11BrO/c11-9-4-2-1-3-8(9)7-10(12)5-6-10/h1-4,12H,5-7H2
InChIKeyDNGYPWBLEFOXHV-UHFFFAOYSA-N
MW227.10 g/mol
LogP2.52
Rot. Bonds2

About 1-[(2-bromophenyl)methyl]cyclopropan-1-ol

1-[(2-bromophenyl)methyl]cyclopropan-1-ol (PubChem CID 84690944) has the molecular formula C10H11BrO and a molecular weight of 227.10 g/mol. Its IUPAC name is 1-[(2-bromophenyl)methyl]cyclopropan-1-ol.

Molecular Properties

Compound Name1-[(2-bromophenyl)methyl]cyclopropan-1-ol
PubChem CID84690944
Molecular FormulaC10H11BrO
Molecular Weight227.10 g/mol
Exact Mass226.00
IUPAC Name1-[(2-bromophenyl)methyl]cyclopropan-1-ol
SMILESOC1(Cc2ccccc2Br)CC1
InChIInChI=1S/C10H11BrO/c11-9-4-2-1-3-8(9)7-10(12)5-6-10/h1-4,12H,5-7H2
InChIKeyDNGYPWBLEFOXHV-UHFFFAOYSA-N
XLogP2.52
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.10
LogP ≤ 52.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1-[(2-bromophenyl)methyl]cyclopropan-1-ol?
The IUPAC name of 1-[(2-bromophenyl)methyl]cyclopropan-1-ol (CID 84690944) is 1-[(2-bromophenyl)methyl]cyclopropan-1-ol.
What is the SMILES notation for 1-[(2-bromophenyl)methyl]cyclopropan-1-ol?
The canonical SMILES for 1-[(2-bromophenyl)methyl]cyclopropan-1-ol is OC1(Cc2ccccc2Br)CC1.
What is the InChIKey of 1-[(2-bromophenyl)methyl]cyclopropan-1-ol?
The InChIKey is DNGYPWBLEFOXHV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11BrO/c11-9-4-2-1-3-8(9)7-10(12)5-6-10/h1-4,12H,5-7H2.
What are the key properties of 1-[(2-bromophenyl)methyl]cyclopropan-1-ol?
1-[(2-bromophenyl)methyl]cyclopropan-1-ol has a molecular weight of 227.10 g/mol, XLogP of 2.52, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(2-bromophenyl)methyl]cyclopropan-1-ol is sourced from PubChem (CID 84690944), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).