(3-氯苄氨基)乙酸
TL;DR: (3-氯苄氨基)乙酸 (CAS 368873-43-2) is a chemical compound with molecular formula C9H10ClNO2 and molecular weight 199.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3-氯苄氨基)乙酸
2-[(3-chlorophenyl)methylamino]acetic acid
Also Known As: (3-Chloro-benzylamino)-acetic acid, N-(3-chlorobenzyl)glycine, 2-[(3-chlorophenyl)methylamino]acetic acid, (3-chlorobenzylamino)acetic acid, (3-Chloro-benzylamino)-aceticacid
| Molecular Formula | C9H10ClNO2 |
|---|---|
| Molecular Weight | 199.04 g/mol |
| LogP | -0.5 |
| Topological Polar Surface Area | 49.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 199.04001 |
| Heavy Atoms | 13 |
| Complexity | 175.0 |
Chemical Identifiers
| CAS Number | 368873-43-2 |
|---|---|
| SMILES | C1=CC(=CC(=C1)Cl)CNCC(=O)O |
| InChIKey | AVQLNLPZBVURGB-UHFFFAOYSA-N |
Product Overview
(3-氯苄氨基)乙酸 (CAS 368873-43-2), with molecular formula C9H10ClNO2 and molecular weight 199.04 g/mol. IUPAC: 2-[(3-chlorophenyl)methylamino]acetic acid.
Chemical Property Profile of (3-氯苄氨基)乙酸
Property Insights of (3-氯苄氨基)乙酸
The XLogP value of -0.5 indicates that (3-氯苄氨基)乙酸 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 49.3 Ų, (3-氯苄氨基)乙酸 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (3-氯苄氨基)乙酸 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
Frequently Asked Questions
What is the CAS number of (3-氯苄氨基)乙酸?
The CAS number of (3-氯苄氨基)乙酸 is 368873-43-2.
What is the molecular formula of (3-氯苄氨基)乙酸?
The molecular formula of (3-氯苄氨基)乙酸 is C9H10ClNO2.
What is the molecular weight of (3-氯苄氨基)乙酸?
The molecular weight of (3-氯苄氨基)乙酸 is 199.04 g/mol.
Where can I buy (3-氯苄氨基)乙酸?
You can request a quote for (3-氯苄氨基)乙酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (3-氯苄氨基)乙酸?
Yes, KEHONG BIO provides custom synthesis services for (3-氯苄氨基)乙酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.