3-(Dimethylamino)phenyl hydrogen benzylcarbonimidate--hydrogen chloride (1/1)
TL;DR: 3-(Dimethylamino)phenyl hydrogen benzylcarbonimidate--hydrogen chloride (1/1) (CAS 63884-81-1) is a chemical compound with molecular formula C16H19ClN2O2 and molecular weight 306.1135 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[3-(benzylcarbamoyloxy)phenyl]-dimethylazanium chloride
Also Known As: Benzylcarbamic ester of 3-oxyphenyldimethylamine hydrochloride, Aniline, 3-(N'-benzylcarbamoyloxy)-N,N-dimethyl-, hydrochloride, [3-(benzylcarbamoyloxy)phenyl]-dimethylazanium chloride, CARBAMIC ACID, N-BENZYL-, 3-(DIMETHYLAMINO)PHENYL ESTER, HYDROCHLORIDE, 3-(Dimethylamino)phenyl hydrogen benzylcarbonimidate--hydrogen chloride (1/1)
Technical Specifications
| Molecular Formula | C16H19ClN2O2 |
| Molecular Weight | 306.1135 g/mol |
| XLogP | -1.24 |
| Topological Polar Surface Area (TPSA) | 42.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 306.1135 Da |
| Heavy Atoms | 21 |
| Complexity | 301.0 |
| SMILES | C[NH+](C)C1=CC(=CC=C1)OC(=O)NCC2=CC=CC=C2.[Cl-] |
| InChIKey | PTARVBVUVIGMJE-UHFFFAOYSA-N |
Chemical Property Profile of 3-(Dimethylamino)phenyl hydrogen benzylcarbonimidate--hydrogen chloride (1/1)
Property Insights of 3-(Dimethylamino)phenyl hydrogen benzylcarbonimidate--hydrogen chloride (1/1)
The XLogP value of -1.24 indicates that 3-(Dimethylamino)phenyl hydrogen benzylcarbonimidate--hydrogen chloride (1/1) is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 42.8 Ų, 3-(Dimethylamino)phenyl hydrogen benzylcarbonimidate--hydrogen chloride (1/1) exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(Dimethylamino)phenyl hydrogen benzylcarbonimidate--hydrogen chloride (1/1) has 2 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 3-(Dimethylamino)phenyl hydrogen benzylcarbonimidate--hydrogen chloride (1/1)?
The CAS number of 3-(Dimethylamino)phenyl hydrogen benzylcarbonimidate--hydrogen chloride (1/1) is 63884-81-1.
What is the molecular formula of 3-(Dimethylamino)phenyl hydrogen benzylcarbonimidate--hydrogen chloride (1/1)?
The molecular formula of 3-(Dimethylamino)phenyl hydrogen benzylcarbonimidate--hydrogen chloride (1/1) is C16H19ClN2O2.
What is the molecular weight of 3-(Dimethylamino)phenyl hydrogen benzylcarbonimidate--hydrogen chloride (1/1)?
The molecular weight of 3-(Dimethylamino)phenyl hydrogen benzylcarbonimidate--hydrogen chloride (1/1) is 306.1135 g/mol.
Where can I buy 3-(Dimethylamino)phenyl hydrogen benzylcarbonimidate--hydrogen chloride (1/1)?
You can request a quote for 3-(Dimethylamino)phenyl hydrogen benzylcarbonimidate--hydrogen chloride (1/1) directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3-(Dimethylamino)phenyl hydrogen benzylcarbonimidate--hydrogen chloride (1/1)?
Yes, CoreyChem provides custom synthesis services for 3-(Dimethylamino)phenyl hydrogen benzylcarbonimidate--hydrogen chloride (1/1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.