2-Methylpropyl amino(phenyl)acetate--hydrogen chloride (1/1)
TL;DR: 2-Methylpropyl amino(phenyl)acetate--hydrogen chloride (1/1) (CAS 87252-83-3) is a chemical compound with molecular formula C12H18ClNO2 and molecular weight 243.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methylpropyl 2-amino-2-phenylacetate;hydrochloride
Also Known As: DL-2-Phenylglycine isobutyl ester hydrochloride, Glycine, 2-phenyl-, isobutyl ester, hydrochloride, DL-, 2-methylpropyl 2-amino-2-phenylacetate hydrochloride, 2-methylpropyl 2-amino-2-phenylacetate,hydrochloride, Benzeneacetic acid, alpha-amino-, 2-methylpropyl ester, hydrochloride, (+-)-
| Molecular Formula | C12H18ClNO2 |
|---|---|
| Molecular Weight | 243.10 g/mol |
| LogP | 2.3074 |
| Topological Polar Surface Area | 52.32 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 243.1026 |
| Heavy Atoms | 16 |
| Complexity | 314.05463 |
Chemical Identifiers
| CAS Number | 87252-83-3 |
|---|---|
| SMILES | CC(C)COC(=O)C(C1=CC=CC=C1)N.Cl |
Product Overview
2-Methylpropyl amino(phenyl)acetate--hydrogen chloride (1/1) (CAS 87252-83-3), with molecular formula C12H18ClNO2 and molecular weight 243.10 g/mol. IUPAC: 2-methylpropyl 2-amino-2-phenylacetate;hydrochloride.
Chemical Property Profile of 2-Methylpropyl amino(phenyl)acetate--hydrogen chloride (1/1)
Property Insights of 2-Methylpropyl amino(phenyl)acetate--hydrogen chloride (1/1)
The XLogP value of 2.3074 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Methylpropyl amino(phenyl)acetate--hydrogen chloride (1/1). With a topological polar surface area (TPSA) of 52.32 Ų, 2-Methylpropyl amino(phenyl)acetate--hydrogen chloride (1/1) exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Methylpropyl amino(phenyl)acetate--hydrogen chloride (1/1) 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 2-Methylpropyl amino(phenyl)acetate--hydrogen chloride (1/1)?
The CAS number of 2-Methylpropyl amino(phenyl)acetate--hydrogen chloride (1/1) is 87252-83-3.
What is the molecular formula of 2-Methylpropyl amino(phenyl)acetate--hydrogen chloride (1/1)?
The molecular formula of 2-Methylpropyl amino(phenyl)acetate--hydrogen chloride (1/1) is C12H18ClNO2.
What is the molecular weight of 2-Methylpropyl amino(phenyl)acetate--hydrogen chloride (1/1)?
The molecular weight of 2-Methylpropyl amino(phenyl)acetate--hydrogen chloride (1/1) is 243.10 g/mol.
Where can I buy 2-Methylpropyl amino(phenyl)acetate--hydrogen chloride (1/1)?
You can request a quote for 2-Methylpropyl amino(phenyl)acetate--hydrogen chloride (1/1) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Methylpropyl amino(phenyl)acetate--hydrogen chloride (1/1)?
Yes, KEHONG BIO provides custom synthesis services for 2-Methylpropyl amino(phenyl)acetate--hydrogen chloride (1/1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.