1-(3-Bromophenoxy)propan-2-one
Plain text
Chemfused. (2026). 1-(3-Bromophenoxy)propan-2-one. Retrieved 2026-04-28 from https://chemfused.com/compound/50897
BibTeX
@misc{chemfused-compound-50897,
title = {1-(3-Bromophenoxy)propan-2-one},
author = {Chemfused},
year = {2026},
url = {https://chemfused.com/compound/50897},
urldate = {2026-04-28}
}
1-(3-Bromophenoxy)propan-2-one is a chemical compound with molecular formula C9H9BrO2 and molecular weight 229.07 g/mol .
What is 1-(3-Bromophenoxy)propan-2-one?
- Molecular Formula
- C9H9BrO2
- Molecular Weight
- 229.07 g/mol
Structure Identifiers
- SMILES
- CC(=O)COC1=CC(=CC=C1)Br
- InChI
- InChI=1S/C9H9BrO2/c1-7(11)6-12-9-4-2-3-8(10)5-9/h2-5H,6H2,1H3
- InChIKey
- LGUCAJHCWJFEEJ-UHFFFAOYSA-N
Properties
Computed
Calculated molecular descriptors used in drug design and computational chemistry.
- Exact Mass
- 227.9786 Da
- XLogP
- 1.70
- TPSA
- 26.3 Ų
- H-Bond Donors
- 0
- H-Bond Acceptors
- 2
- Complexity
- 159
- Formal Charge
- 0
Safety information
No safety data available for this chemical.
Synonyms (14)
- AB26134
- NS-02928
- 853402-77-4
- MFCD06659706
- AKOS008908261
- SCHEMBL670856
- starbld0036936
- SCHEMBL31145073
- 1-(3-bromophenoxyl)acetone
- LGUCAJHCWJFEEJ-UHFFFAOYSA-N
- 1-(3-BROMOPHENOXY)-2-PROPANONE
- 1-(3-BROMOPHENOXY)PROPAN-2-ONE
- 1-(3-Bromo-phenoxy)-propan-2-one
- 1-(3-Bromophenoxy)acetone, AldrichCPR
Frequently asked questions
What is the molecular formula of 1-(3-Bromophenoxy)propan-2-one?
1-(3-Bromophenoxy)propan-2-one has the molecular formula C9H9BrO2 and a molecular weight of 229.07 g/mol.
What is the SMILES notation for 1-(3-Bromophenoxy)propan-2-one?
The SMILES notation for 1-(3-Bromophenoxy)propan-2-one is CC(=O)COC1=CC(=CC=C1)Br.
What are other names for 1-(3-Bromophenoxy)propan-2-one?
1-(3-Bromophenoxy)propan-2-one is also known as 1-(3-Bromo-phenoxy)-propan-2-one, 1-(3-BROMOPHENOXY)-2-PROPANONE, 1-(3-Bromophenoxy)acetone, AldrichCPR, 1-(3-BROMOPHENOXY)PROPAN-2-ONE, 1-(3-bromophenoxyl)acetone.
Data sourced from PubChem CID 52106499. Last updated .
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