InChI=1/C3H9BBrN/c1-4(5)6(2)3/h1-3H
TL;DR: InChI=1/C3H9BBrN/c1-4(5)6(2)3/h1-3H (CAS 18494-96-7) is a chemical compound with molecular formula C3H9BBrN and molecular weight 149.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[bromo(methyl)boranyl]-N-methylmethanamine
Also Known As: dimethylamino(methyl)bromoborane, N-[bromo(methyl)boranyl]-N-methylmethanamine, N-(bromo-methyl-boranyl)-N-methyl-methanamine, InChI=1/C3H9BBrN/c1-4(5)6(2)3/h1-3H
| Molecular Formula | C3H9BBrN |
|---|---|
| Molecular Weight | 149.00 g/mol |
| LogP | 1.0609 |
| Topological Polar Surface Area | 3.24 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 149.00114 |
| Heavy Atoms | 6 |
| Complexity | 31.774437 |
Chemical Identifiers
| CAS Number | 18494-96-7 |
|---|---|
| SMILES | B(C)(N(C)C)Br |
Product Overview
InChI=1/C3H9BBrN/c1-4(5)6(2)3/h1-3H (CAS 18494-96-7), with molecular formula C3H9BBrN and molecular weight 149.00 g/mol. IUPAC: N-[bromo(methyl)boranyl]-N-methylmethanamine.
Chemical Property Profile of InChI=1/C3H9BBrN/c1-4(5)6(2)3/h1-3H
Property Insights of InChI=1/C3H9BBrN/c1-4(5)6(2)3/h1-3H
The XLogP value of 1.0609 suggests moderate lipophilicity, balancing water solubility and membrane permeability for InChI=1/C3H9BBrN/c1-4(5)6(2)3/h1-3H. With a topological polar surface area (TPSA) of 3.24 Ų, InChI=1/C3H9BBrN/c1-4(5)6(2)3/h1-3H exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, InChI=1/C3H9BBrN/c1-4(5)6(2)3/h1-3H has 0 hydrogen bond donor(s) and 1 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 InChI=1/C3H9BBrN/c1-4(5)6(2)3/h1-3H?
The CAS number of InChI=1/C3H9BBrN/c1-4(5)6(2)3/h1-3H is 18494-96-7.
What is the molecular formula of InChI=1/C3H9BBrN/c1-4(5)6(2)3/h1-3H?
The molecular formula of InChI=1/C3H9BBrN/c1-4(5)6(2)3/h1-3H is C3H9BBrN.
What is the molecular weight of InChI=1/C3H9BBrN/c1-4(5)6(2)3/h1-3H?
The molecular weight of InChI=1/C3H9BBrN/c1-4(5)6(2)3/h1-3H is 149.00 g/mol.
Where can I buy InChI=1/C3H9BBrN/c1-4(5)6(2)3/h1-3H?
You can request a quote for InChI=1/C3H9BBrN/c1-4(5)6(2)3/h1-3H directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for InChI=1/C3H9BBrN/c1-4(5)6(2)3/h1-3H?
Yes, KEHONG BIO provides custom synthesis services for InChI=1/C3H9BBrN/c1-4(5)6(2)3/h1-3H and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.