CARBAMIC ACID, N-METHYL-, o-(ALLYLOXY)PHENYL ESTER
TL;DR: CARBAMIC ACID, N-METHYL-, o-(ALLYLOXY)PHENYL ESTER (CAS 4062-99-1) is a chemical compound with molecular formula C11H13NO3 and molecular weight 207.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2-prop-2-enoxyphenyl) N-methylcarbamate
Also Known As: Hercules 9,485, Hercules 9485, o-(Allyloxy)phenyl methylcarbamate, He 9485, HRS 9485
| Molecular Formula | C11H13NO3 |
|---|---|
| Molecular Weight | 207.09 g/mol |
| LogP | 1.5 |
| Topological Polar Surface Area | 47.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 207.08954 |
| Heavy Atoms | 15 |
| Complexity | 218.0 |
Chemical Identifiers
| CAS Number | 4062-99-1 |
|---|---|
| SMILES | CNC(=O)OC1=CC=CC=C1OCC=C |
| InChIKey | RRCXOIBMSKRASZ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
CARBAMIC ACID, N-METHYL-, o-(ALLYLOXY)PHENYL ESTER (CAS 4062-99-1), with molecular formula C11H13NO3 and molecular weight 207.09 g/mol. IUPAC: (2-prop-2-enoxyphenyl) N-methylcarbamate.
Chemical Property Profile of CARBAMIC ACID, N-METHYL-, o-(ALLYLOXY)PHENYL ESTER
Property Insights of CARBAMIC ACID, N-METHYL-, o-(ALLYLOXY)PHENYL ESTER
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for CARBAMIC ACID, N-METHYL-, o-(ALLYLOXY)PHENYL ESTER. With a topological polar surface area (TPSA) of 47.6 Ų, CARBAMIC ACID, N-METHYL-, o-(ALLYLOXY)PHENYL ESTER exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, CARBAMIC ACID, N-METHYL-, o-(ALLYLOXY)PHENYL ESTER has 1 hydrogen bond donor(s) and 3 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 CARBAMIC ACID, N-METHYL-, o-(ALLYLOXY)PHENYL ESTER?
The CAS number of CARBAMIC ACID, N-METHYL-, o-(ALLYLOXY)PHENYL ESTER is 4062-99-1.
What is the molecular formula of CARBAMIC ACID, N-METHYL-, o-(ALLYLOXY)PHENYL ESTER?
The molecular formula of CARBAMIC ACID, N-METHYL-, o-(ALLYLOXY)PHENYL ESTER is C11H13NO3.
What is the molecular weight of CARBAMIC ACID, N-METHYL-, o-(ALLYLOXY)PHENYL ESTER?
The molecular weight of CARBAMIC ACID, N-METHYL-, o-(ALLYLOXY)PHENYL ESTER is 207.09 g/mol.
Where can I buy CARBAMIC ACID, N-METHYL-, o-(ALLYLOXY)PHENYL ESTER?
You can request a quote for CARBAMIC ACID, N-METHYL-, o-(ALLYLOXY)PHENYL ESTER directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CARBAMIC ACID, N-METHYL-, o-(ALLYLOXY)PHENYL ESTER?
Yes, KEHONG BIO provides custom synthesis services for CARBAMIC ACID, N-METHYL-, o-(ALLYLOXY)PHENYL ESTER and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.