苄基氨基甲酸
TL;DR: 苄基氨基甲酸 (CAS 85600-10-8) is a chemical compound with molecular formula C8H9NO2 and molecular weight 151.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
苄基氨基甲酸
benzylcarbamic acid
Also Known As: Benzylcarbamic Acid, n-benzylcarbamic acid, monomeric N-benzylcarbamic acid, benzylcarbamic acid,phenylmethanamine, (4-BROMO-PHENYLSULFANYL)-ACETICACID
| Molecular Formula | C8H9NO2 |
|---|---|
| Molecular Weight | 151.06 g/mol |
| LogP | 1.0 |
| Topological Polar Surface Area | 49.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 151.06332 |
| Heavy Atoms | 11 |
| Complexity | 130.0 |
Chemical Identifiers
| CAS Number | 85600-10-8 |
|---|---|
| SMILES | C1=CC=C(C=C1)CNC(=O)O |
| InChIKey | RRIWSQXXBIFKQM-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 19 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
苄基氨基甲酸 (CAS 85600-10-8), with molecular formula C8H9NO2 and molecular weight 151.06 g/mol. IUPAC: benzylcarbamic acid.
Chemical Property Profile of 苄基氨基甲酸
Property Insights of 苄基氨基甲酸
The XLogP value of 1.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 苄基氨基甲酸. With a topological polar surface area (TPSA) of 49.3 Ų, 苄基氨基甲酸 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 苄基氨基甲酸 has 2 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 苄基氨基甲酸?
The CAS number of 苄基氨基甲酸 is 85600-10-8.
What is the molecular formula of 苄基氨基甲酸?
The molecular formula of 苄基氨基甲酸 is C8H9NO2.
What is the molecular weight of 苄基氨基甲酸?
The molecular weight of 苄基氨基甲酸 is 151.06 g/mol.
Where can I buy 苄基氨基甲酸?
You can request a quote for 苄基氨基甲酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 苄基氨基甲酸?
Yes, KEHONG BIO provides custom synthesis services for 苄基氨基甲酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.