Carbazic acid, 3-(1-propylbutylidene)-, methyl ester
TL;DR: Carbazic acid, 3-(1-propylbutylidene)-, methyl ester (CAS 14978-96-2) is a chemical compound with molecular formula C9H18N2O2 and molecular weight 186.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl N-(heptan-4-ylideneamino)carbamate
Also Known As: methyl N-(heptan-4-ylideneamino)carbamate, Carbazic acid, 3-(1-propylbutylidene)-, methyl ester, N'-(heptan-4-ylidene)methoxycarbohydrazide, methyl 2-(heptan-4-ylidene)hydrazinecarboxylate, 3-(1-Propylbutylidene)carbazic acid methyl ester
| Molecular Formula | C9H18N2O2 |
|---|---|
| Molecular Weight | 186.14 g/mol |
| LogP | 1.8 |
| Topological Polar Surface Area | 50.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 186.13683 |
| Heavy Atoms | 13 |
| Complexity | 170.0 |
Chemical Identifiers
| CAS Number | 14978-96-2 |
|---|---|
| SMILES | CCCC(=NNC(=O)OC)CCC |
| InChIKey | JLBAWEHEGKDKSY-UHFFFAOYSA-N |
Product Overview
Carbazic acid, 3-(1-propylbutylidene)-, methyl ester (CAS 14978-96-2), with molecular formula C9H18N2O2 and molecular weight 186.14 g/mol. IUPAC: methyl N-(heptan-4-ylideneamino)carbamate.
Chemical Property Profile of Carbazic acid, 3-(1-propylbutylidene)-, methyl ester
Property Insights of Carbazic acid, 3-(1-propylbutylidene)-, methyl ester
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Carbazic acid, 3-(1-propylbutylidene)-, methyl ester. With a topological polar surface area (TPSA) of 50.7 Ų, Carbazic acid, 3-(1-propylbutylidene)-, methyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Carbazic acid, 3-(1-propylbutylidene)-, 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 Carbazic acid, 3-(1-propylbutylidene)-, methyl ester?
The CAS number of Carbazic acid, 3-(1-propylbutylidene)-, methyl ester is 14978-96-2.
What is the molecular formula of Carbazic acid, 3-(1-propylbutylidene)-, methyl ester?
The molecular formula of Carbazic acid, 3-(1-propylbutylidene)-, methyl ester is C9H18N2O2.
What is the molecular weight of Carbazic acid, 3-(1-propylbutylidene)-, methyl ester?
The molecular weight of Carbazic acid, 3-(1-propylbutylidene)-, methyl ester is 186.14 g/mol.
Where can I buy Carbazic acid, 3-(1-propylbutylidene)-, methyl ester?
You can request a quote for Carbazic acid, 3-(1-propylbutylidene)-, methyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Carbazic acid, 3-(1-propylbutylidene)-, methyl ester?
Yes, KEHONG BIO provides custom synthesis services for Carbazic acid, 3-(1-propylbutylidene)-, methyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.