Home Carboxys tert-Butyl 3-cyano-3-((2,4-dimethoxybenzyl)amino)azetidine-1-carboxylate

tert-Butyl 3-cyano-3-((2,4-dimethoxybenzyl)amino)azetidine-1-carboxylate

CAS No.:
1629579-52-7
Catalog Number:
AG01DFMS
Molecular Formula:
C18H25N3O4
Molecular Weight:
347.4088
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
100mg
95%
In Stock USA
United States
$133
- +
250mg
95%
In Stock USA
United States
$221
- +
1g
95%
In Stock USA
United States
$441
- +
5g
95%
In Stock USA
United States
$1323
- +
Product Description
Catalog Number:
AG01DFMS
Chemical Name:
tert-Butyl 3-cyano-3-((2,4-dimethoxybenzyl)amino)azetidine-1-carboxylate
CAS Number:
1629579-52-7
Molecular Formula:
C18H25N3O4
Molecular Weight:
347.4088
MDL Number:
MFCD30472085
IUPAC Name:
tert-butyl 3-cyano-3-[(2,4-dimethoxyphenyl)methylamino]azetidine-1-carboxylate
InChI:
InChI=1S/C18H25N3O4/c1-17(2,3)25-16(22)21-11-18(10-19,12-21)20-9-13-6-7-14(23-4)8-15(13)24-5/h6-8,20H,9,11-12H2,1-5H3
InChI Key:
BJDLYJRUGUGVLH-UHFFFAOYSA-N
SMILES:
N#CC1(NCc2ccc(cc2OC)OC)CN(C1)C(=O)OC(C)(C)C
Properties
Complexity:
516  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
347.185g/mol
Formal Charge:
0
Heavy Atom Count:
25  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
347.415g/mol
Monoisotopic Mass:
347.185g/mol
Rotatable Bond Count:
7  
Topological Polar Surface Area:
83.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5  
Properties