CAS
96027-84-8 Purity
96%
96027-84-8 Purity
96%
Shopping basket
tert-Butyl 2-(2-chloroethyl)-2-cyanopyrrolidine-1-carboxylate
CAS
960294-12-6
Catalog Number
ACM960294126
Category
Other Products
Molecular Weight
258.744460 [g/mol]
Molecular Formula
C12H19ClN2O2
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
tert-butyl 2-(2-chloroethyl)-2-cyanopyrrolidine-1-carboxylate, 960294-12-6, AKOS016011531, AK120773, KB-260216, AM20120386, FT-0688619, 1-Pyrrolidinecarboxylic acid, 2-(2-chloroethyl)-2-cyano-, 1,1-dimethylethyl ester
IUPAC Name
tert-butyl 2-(2-chloroethyl)-2-cyanopyrrolidine-1-carboxylate
SMILES
CC(C)(C)OC(=O)N1CCCC1(CCCl)C#N
InChI Key
HYQLUBITXSSPQS-UHFFFAOYSA-N
Exact Mass
258.11400
H-Bond Acceptor
3
H-Bond Donor
0
What is the molecular formula of tert-butyl 2-(2-chloroethyl)-2-cyanopyrrolidine-1-carboxylate?
The molecular formula is C12H19ClN2O2.
When was tert-butyl 2-(2-chloroethyl)-2-cyanopyrrolidine-1-carboxylate created in PubChem?
It was created on 2008-03-03.
What is the IUPAC name of tert-butyl 2-(2-chloroethyl)-2-cyanopyrrolidine-1-carboxylate?
The IUPAC name is tert-butyl 2-(2-chloroethyl)-2-cyanopyrrolidine-1-carboxylate.
What is the InChIKey of tert-butyl 2-(2-chloroethyl)-2-cyanopyrrolidine-1-carboxylate?
The InChIKey is HYQLUBITXSSPQS-UHFFFAOYSA-N.
What is the XLogP3-AA value of tert-butyl 2-(2-chloroethyl)-2-cyanopyrrolidine-1-carboxylate?
The XLogP3-AA value is 2.2.
How many hydrogen bond acceptors does tert-butyl 2-(2-chloroethyl)-2-cyanopyrrolidine-1-carboxylate have?
It has 3 hydrogen bond acceptors.
What is the exact mass of tert-butyl 2-(2-chloroethyl)-2-cyanopyrrolidine-1-carboxylate?
The exact mass is 258.1135055 g/mol.
What is the topological polar surface area of tert-butyl 2-(2-chloroethyl)-2-cyanopyrrolidine-1-carboxylate?
The topological polar surface area is 53.3 Ų.
How many heavy atoms are present in tert-butyl 2-(2-chloroethyl)-2-cyanopyrrolidine-1-carboxylate?
There are 17 heavy atoms.
Is the compound canonicalized in PubChem?
Yes, the compound is canonicalized in PubChem.
Please kindly note that our products are for research use only.
Recommended Products
CAS
960294-15-9 Purity
96%
960294-15-9 Purity
96%
