3-chloropropyl N-phenylcarbamate
TL;DR: 3-chloropropyl N-phenylcarbamate (CAS 7507-38-2) is a chemical compound with molecular formula C10H12ClNO2 and molecular weight 213.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-chloropropyl N-phenylcarbamate
Also Known As: 3-chloropropyl N-phenylcarbamate, 3-Chloropropyl phenylcarbamate, 3-Chloropropyl phenylcarbamate #, 1-Propanol, 3-chloro-, phenylcarbamate, RefChem:278638
| Molecular Formula | C10H12ClNO2 |
|---|---|
| Molecular Weight | 213.06 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 38.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 213.05565 |
| Heavy Atoms | 14 |
| Complexity | 170.0 |
Chemical Identifiers
| CAS Number | 7507-38-2 |
|---|---|
| SMILES | C1=CC=C(C=C1)NC(=O)OCCCCl |
| InChIKey | PWYHRNYXPUTOMA-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-chloropropyl N-phenylcarbamate (CAS 7507-38-2), with molecular formula C10H12ClNO2 and molecular weight 213.06 g/mol. IUPAC: 3-chloropropyl N-phenylcarbamate.
Chemical Property Profile of 3-chloropropyl N-phenylcarbamate
Property Insights of 3-chloropropyl N-phenylcarbamate
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-chloropropyl N-phenylcarbamate. With a topological polar surface area (TPSA) of 38.3 Ų, 3-chloropropyl N-phenylcarbamate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-chloropropyl N-phenylcarbamate has 1 hydrogen bond donor(s) and 2 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 3-chloropropyl N-phenylcarbamate?
The CAS number of 3-chloropropyl N-phenylcarbamate is 7507-38-2.
What is the molecular formula of 3-chloropropyl N-phenylcarbamate?
The molecular formula of 3-chloropropyl N-phenylcarbamate is C10H12ClNO2.
What is the molecular weight of 3-chloropropyl N-phenylcarbamate?
The molecular weight of 3-chloropropyl N-phenylcarbamate is 213.06 g/mol.
Where can I buy 3-chloropropyl N-phenylcarbamate?
You can request a quote for 3-chloropropyl N-phenylcarbamate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-chloropropyl N-phenylcarbamate?
Yes, KEHONG BIO provides custom synthesis services for 3-chloropropyl N-phenylcarbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.