(4-bromophenyl)-(1-phenylcyclopropyl)methanol

C16H15BrO — CID 62879537

IUPAC(4-bromophenyl)-(1-phenylcyclopropyl)methanol
SMILESOC(c1ccc(Br)cc1)C1(c2ccccc2)CC1
InChIInChI=1S/C16H15BrO/c17-14-8-6-12(7-9-14)15(18)16(10-11-16)13-4-2-1-3-5-13/h1-9,15,18H,10-11H2
InChIKeyAOZQKHGORLDUNY-UHFFFAOYSA-N
MW303.20 g/mol
LogP4.21
Rot. Bonds3

About (4-bromophenyl)-(1-phenylcyclopropyl)methanol

(4-bromophenyl)-(1-phenylcyclopropyl)methanol (PubChem CID 62879537) has the molecular formula C16H15BrO and a molecular weight of 303.20 g/mol. Its IUPAC name is (4-bromophenyl)-(1-phenylcyclopropyl)methanol.

Molecular Properties

Compound Name(4-bromophenyl)-(1-phenylcyclopropyl)methanol
PubChem CID62879537
Molecular FormulaC16H15BrO
Molecular Weight303.20 g/mol
Exact Mass302.03
IUPAC Name(4-bromophenyl)-(1-phenylcyclopropyl)methanol
SMILESOC(c1ccc(Br)cc1)C1(c2ccccc2)CC1
InChIInChI=1S/C16H15BrO/c17-14-8-6-12(7-9-14)15(18)16(10-11-16)13-4-2-1-3-5-13/h1-9,15,18H,10-11H2
InChIKeyAOZQKHGORLDUNY-UHFFFAOYSA-N
XLogP4.21
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.20
LogP ≤ 54.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of (4-bromophenyl)-(1-phenylcyclopropyl)methanol?
The IUPAC name of (4-bromophenyl)-(1-phenylcyclopropyl)methanol (CID 62879537) is (4-bromophenyl)-(1-phenylcyclopropyl)methanol.
What is the SMILES notation for (4-bromophenyl)-(1-phenylcyclopropyl)methanol?
The canonical SMILES for (4-bromophenyl)-(1-phenylcyclopropyl)methanol is OC(c1ccc(Br)cc1)C1(c2ccccc2)CC1.
What is the InChIKey of (4-bromophenyl)-(1-phenylcyclopropyl)methanol?
The InChIKey is AOZQKHGORLDUNY-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15BrO/c17-14-8-6-12(7-9-14)15(18)16(10-11-16)13-4-2-1-3-5-13/h1-9,15,18H,10-11H2.
What are the key properties of (4-bromophenyl)-(1-phenylcyclopropyl)methanol?
(4-bromophenyl)-(1-phenylcyclopropyl)methanol has a molecular weight of 303.20 g/mol, XLogP of 4.21, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (4-bromophenyl)-(1-phenylcyclopropyl)methanol is sourced from PubChem (CID 62879537), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).