1-(Bromoacetyl)indoline
TL;DR: 1-(Bromoacetyl)indoline (CAS 7399-80-6) is a chemical compound with molecular formula C10H10BrNO and molecular weight 238.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-bromo-1-(2,3-dihydroindol-1-yl)ethanone
Also Known As: 1-(Bromoacetyl)indoline, 2-Bromo-1-(indolin-1-yl)ethanone, N-(2-bromoacetyl)indoline, 1-(Bromoacetyl)indoline #, 2-bromo-1-indolinylethan-1-one
| Molecular Formula | C10H10BrNO |
|---|---|
| Molecular Weight | 238.99 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 20.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 238.99458 |
| Heavy Atoms | 13 |
| Complexity | 207.0 |
Chemical Identifiers
| CAS Number | 7399-80-6 |
|---|---|
| SMILES | C1CN(C2=CC=CC=C21)C(=O)CBr |
| InChIKey | NCHBDJXOHMIGRE-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-(Bromoacetyl)indoline (CAS 7399-80-6), with molecular formula C10H10BrNO and molecular weight 238.99 g/mol. IUPAC: 2-bromo-1-(2,3-dihydroindol-1-yl)ethanone.
Chemical Property Profile of 1-(Bromoacetyl)indoline
Property Insights of 1-(Bromoacetyl)indoline
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(Bromoacetyl)indoline. With a topological polar surface area (TPSA) of 20.3 Ų, 1-(Bromoacetyl)indoline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(Bromoacetyl)indoline has 0 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1-(Bromoacetyl)indoline?
The CAS number of 1-(Bromoacetyl)indoline is 7399-80-6.
What is the molecular formula of 1-(Bromoacetyl)indoline?
The molecular formula of 1-(Bromoacetyl)indoline is C10H10BrNO.
What is the molecular weight of 1-(Bromoacetyl)indoline?
The molecular weight of 1-(Bromoacetyl)indoline is 238.99 g/mol.
Where can I buy 1-(Bromoacetyl)indoline?
You can request a quote for 1-(Bromoacetyl)indoline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(Bromoacetyl)indoline?
Yes, KEHONG BIO provides custom synthesis services for 1-(Bromoacetyl)indoline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.