CAS
97-21-2 Purity
---
97-21-2 Purity
---
Inquiry Basket
1-Benzyl-4-(o-toluidino)piperidine-4-carbonitrile
CAS
972-17-8
Catalog Number
ACM972178
Category
Other Products
Molecular Weight
305.4167
Molecular Formula
C20H23N3
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
MLS002693816, NSC73008, MolPort-001-814-225, AIDS125460, AIDS-125460, CID70415, EINECS 213-541-4, NSC 73008, SMR001559757, 1-Benzyl-4-(o-toluidino)piperidine-4-carbonitrile, 1-Benzyl-4-(2-toluidino)-4-piperidinecarbonitrile, 972-17-8
IUPAC Name
1-benzyl-4-(2-methylanilino)piperidine-4-carbonitrile
Canonical SMILES
CC1=CC=CC=C1NC2(CCN(CC2)CC3=CC=CC=C3)C#N
InChI Key
PZPLFWQZPIAMRU-UHFFFAOYSA-N
Boiling Point
483.6ºC at 760mmHg
Flash Point
246.3ºC
Density
1.13g/cm³
EC Number
213-541-4
Exact Mass
305.18900
H-Bond Acceptor
3
H-Bond Donor
1
What is the molecular formula of 1-Benzyl-4-(o-toluidino)piperidine-4-carbonitrile?
The molecular formula is C20H23N3.
When was the chemical first created?
The chemical was first created on March 26, 2005.
What is the molecular weight of 1-Benzyl-4-(o-toluidino)piperidine-4-carbonitrile?
The molecular weight is 305.4 g/mol.
What is the IUPAC name of this chemical?
The IUPAC name is 1-benzyl-4-(2-methylanilino)piperidine-4-carbonitrile.
What is the InChIKey of this compound?
The InChIKey is PZPLFWQZPIAMRU-UHFFFAOYSA-N.
How many hydrogen bond donor counts does this compound have?
The compound has 1 hydrogen bond donor count.
What is the topological polar surface area of this chemical?
The topological polar surface area is 39.1Å2.
How many rotatable bond counts does this compound have?
The compound has 4 rotatable bond counts.
Is the compound canonicalized?
Yes, the compound is canonicalized.
What is the CAS number of this chemical?
The CAS number is 972-17-8.
Recommended Products
![Boric acid,tris[2-(dimethylamino)ethyl]ester](https://resource.alfa-chemistry.com/structure/97-21-2.gif)
CAS
97216-16-5 Purity
96%
97216-16-5 Purity
96%
