Home Carboxys tert-butyl 3-amino-3-cyanoazetidine-1-carboxylate

tert-butyl 3-amino-3-cyanoazetidine-1-carboxylate

CAS No.:
1254120-12-1
Catalog Number:
AG00IKZR
Molecular Formula:
C9H15N3O2
Molecular Weight:
197.2343
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
97%
1 week
United States
$577
- +
Product Description
Catalog Number:
AG00IKZR
Chemical Name:
tert-butyl 3-amino-3-cyanoazetidine-1-carboxylate
CAS Number:
1254120-12-1
Molecular Formula:
C9H15N3O2
Molecular Weight:
197.2343
MDL Number:
MFCD21842588
IUPAC Name:
tert-butyl 3-amino-3-cyanoazetidine-1-carboxylate
InChI:
InChI=1S/C9H15N3O2/c1-8(2,3)14-7(13)12-5-9(11,4-10)6-12/h5-6,11H2,1-3H3
InChI Key:
BTLBBSVDHIWMDW-UHFFFAOYSA-N
SMILES:
N#CC1(N)CN(C1)C(=O)OC(C)(C)C
Properties
Complexity:
291  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
197.116g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
197.238g/mol
Monoisotopic Mass:
197.116g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
79.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.4  
Properties