CAS
954236-23-8 Purity
---
954236-23-8 Purity
---
Inquiry Basket
2,4,5,6,7,8-Hexahydro-1,2,3a,6-tetraaza-azulen-3-one
CAS
954236-41-0
Catalog Number
ACM954236410
Category
Other Products
Molecular Weight
154.1698
Molecular Formula
C6H10N4O
If you have any other questions or need other size, please get a quote.
- Product Description
- Case Study
- Custom Reviews
- Custom Q&A
- Synthetic Use
- Related Resources
Specification
Synonyms
2,4,5,6,7,8-Hexahydro-1,2,3a,6-tetraaza-azulen-3-one
What is the molecular formula of the compound?
The molecular formula is C6H10N4O.
What is the molecular weight of the compound?
The molecular weight is 154.17 g/mol.
What is the IUPAC Name of the compound?
The IUPAC Name is 2,5,6,7,8,9-hexahydro-[1,2,4]triazolo[4,3-d][1,4]diazepin-3-one.
What is the InChI of the compound?
The InChI is InChI=1S/C6H10N4O/c11-6-9-8-5-1-2-7-3-4-10(5)6/h7H,1-4H2,(H,9,11).
What is the InChIKey of the compound?
The InChIKey is NXARAJDGBBUYRB-UHFFFAOYSA-N.
What is the canonical SMILES of the compound?
The canonical SMILES is C1CNCCN2C1=NNC2=O.
What is the CAS number of the compound?
The CAS number is 954236-41-0.
How many hydrogen bond donor counts does the compound have?
The compound has 2 hydrogen bond donor counts.
How many hydrogen bond acceptor counts does the compound have?
The compound has 3 hydrogen bond acceptor counts.
How many rotatable bond counts does the compound have?
The compound has 0 rotatable bond counts.
Recommended Products
![7-Oxa-12-thia-spiro[5.6]dodecan-3-one](https://resource.alfa-chemistry.com/structure/954236-23-8.gif)
![2-(3-Nitro-phenyl)-[1,3]oxathiepane](https://resource.alfa-chemistry.com/structure/954236-28-3.gif)
CAS
954236-38-5 Purity
---
954236-38-5 Purity
---
![N-Boc-3-oxo-1-oxa-8-aza-spiro[4.5]decane](https://resource.alfa-chemistry.com/structure/954236-44-3.gif)
CAS
954238-37-0 Purity
---
954238-37-0 Purity
---
