![{[(苄氧基)羰基]氨基}甲磺酸 structure](/static/products/989/98996-96-4.png)
{[(苄氧基)羰基]氨基}甲磺酸
TL;DR: {[(苄氧基)羰基]氨基}甲磺酸 (CAS 98996-96-4) is a chemical compound with molecular formula C9H11NO5S and molecular weight 245.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
{[(苄氧基)羰基]氨基}甲磺酸
phenylmethoxycarbonylaminomethanesulfonic acid
Also Known As: {[(benzyloxy)carbonyl]amino}methanesulfonic acid, phenylmethoxycarbonylaminomethanesulfonic acid
| Molecular Formula | C9H11NO5S |
|---|---|
| Molecular Weight | 245.04 g/mol |
| LogP | 0.4 |
| Topological Polar Surface Area | 101.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 245.0358 |
| Heavy Atoms | 16 |
| Complexity | 315.0 |
Chemical Identifiers
| CAS Number | 98996-96-4 |
|---|---|
| SMILES | C1=CC=C(C=C1)COC(=O)NCS(=O)(=O)O |
| InChIKey | QYVOCWMDMWLYCB-UHFFFAOYSA-N |
Product Overview
{[(苄氧基)羰基]氨基}甲磺酸 (CAS 98996-96-4), with molecular formula C9H11NO5S and molecular weight 245.04 g/mol. IUPAC: phenylmethoxycarbonylaminomethanesulfonic acid.
Chemical Property Profile of {[(苄氧基)羰基]氨基}甲磺酸
Property Insights of {[(苄氧基)羰基]氨基}甲磺酸
The XLogP value of 0.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for {[(苄氧基)羰基]氨基}甲磺酸. The TPSA of 101.0 Ų falls within the moderate polarity range, balancing permeability and solubility for {[(苄氧基)羰基]氨基}甲磺酸. Following Lipinski's Rule of Five, {[(苄氧基)羰基]氨基}甲磺酸 has 2 hydrogen bond donor(s) and 5 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 {[(苄氧基)羰基]氨基}甲磺酸?
The CAS number of {[(苄氧基)羰基]氨基}甲磺酸 is 98996-96-4.
What is the molecular formula of {[(苄氧基)羰基]氨基}甲磺酸?
The molecular formula of {[(苄氧基)羰基]氨基}甲磺酸 is C9H11NO5S.
What is the molecular weight of {[(苄氧基)羰基]氨基}甲磺酸?
The molecular weight of {[(苄氧基)羰基]氨基}甲磺酸 is 245.04 g/mol.
Where can I buy {[(苄氧基)羰基]氨基}甲磺酸?
You can request a quote for {[(苄氧基)羰基]氨基}甲磺酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for {[(苄氧基)羰基]氨基}甲磺酸?
Yes, KEHONG BIO provides custom synthesis services for {[(苄氧基)羰基]氨基}甲磺酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.