2-Butylidenehydrazine-1-carboxylic acid methyl ester
TL;DR: 2-Butylidenehydrazine-1-carboxylic acid methyl ester (CAS 55401-87-1) is a chemical compound with molecular formula C6H12N2O2 and molecular weight 144.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl N-(butylideneamino)carbamate
Also Known As: methyl N-(butylideneamino)carbamate, Methyl (2E)-2-butylidenehydrazinecarboxylate, 2-Butylidenehydrazine-1-carboxylicacidmethylester, 2-Butylidenehydrazine-1-carboxylic acid methyl ester
| Molecular Formula | C6H12N2O2 |
|---|---|
| Molecular Weight | 144.09 g/mol |
| LogP | 0.7 |
| Topological Polar Surface Area | 50.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 144.08987 |
| Heavy Atoms | 10 |
| Complexity | 123.0 |
Chemical Identifiers
| CAS Number | 55401-87-1 |
|---|---|
| SMILES | CCCC=NNC(=O)OC |
| InChIKey | ZWYJFGRUCXHXLN-UHFFFAOYSA-N |
Product Overview
2-Butylidenehydrazine-1-carboxylic acid methyl ester (CAS 55401-87-1), with molecular formula C6H12N2O2 and molecular weight 144.09 g/mol. IUPAC: methyl N-(butylideneamino)carbamate.
Chemical Property Profile of 2-Butylidenehydrazine-1-carboxylic acid methyl ester
Property Insights of 2-Butylidenehydrazine-1-carboxylic acid methyl ester
The XLogP value of 0.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Butylidenehydrazine-1-carboxylic acid methyl ester. With a topological polar surface area (TPSA) of 50.7 Ų, 2-Butylidenehydrazine-1-carboxylic acid methyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Butylidenehydrazine-1-carboxylic acid methyl ester 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-Butylidenehydrazine-1-carboxylic acid methyl ester?
The CAS number of 2-Butylidenehydrazine-1-carboxylic acid methyl ester is 55401-87-1.
What is the molecular formula of 2-Butylidenehydrazine-1-carboxylic acid methyl ester?
The molecular formula of 2-Butylidenehydrazine-1-carboxylic acid methyl ester is C6H12N2O2.
What is the molecular weight of 2-Butylidenehydrazine-1-carboxylic acid methyl ester?
The molecular weight of 2-Butylidenehydrazine-1-carboxylic acid methyl ester is 144.09 g/mol.
Where can I buy 2-Butylidenehydrazine-1-carboxylic acid methyl ester?
You can request a quote for 2-Butylidenehydrazine-1-carboxylic acid methyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Butylidenehydrazine-1-carboxylic acid methyl ester?
Yes, KEHONG BIO provides custom synthesis services for 2-Butylidenehydrazine-1-carboxylic acid methyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.