Home Carboxys tert-butyl 3-(cyanomethyl)-4,4-dimethyl-2,5-dioxoimidazolidine-1-carboxylate

tert-butyl 3-(cyanomethyl)-4,4-dimethyl-2,5-dioxoimidazolidine-1-carboxylate

CAS No.:
1306604-83-0
Catalog Number:
AG01AHXQ
Molecular Formula:
C12H17N3O4
Molecular Weight:
267.2811
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Product Description
Catalog Number:
AG01AHXQ
Chemical Name:
tert-butyl 3-(cyanomethyl)-4,4-dimethyl-2,5-dioxoimidazolidine-1-carboxylate
CAS Number:
1306604-83-0
Molecular Formula:
C12H17N3O4
Molecular Weight:
267.2811
MDL Number:
MFCD18838742
IUPAC Name:
tert-butyl 3-(cyanomethyl)-4,4-dimethyl-2,5-dioxoimidazolidine-1-carboxylate
InChI:
InChI=1S/C12H17N3O4/c1-11(2,3)19-10(18)15-8(16)12(4,5)14(7-6-13)9(15)17/h7H2,1-5H3
InChI Key:
IHJJXOKHRFPVCM-UHFFFAOYSA-N
SMILES:
N#CCN1C(=O)N(C(=O)C1(C)C)C(=O)OC(C)(C)C
Properties
Complexity:
481  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
267.122g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
267.285g/mol
Monoisotopic Mass:
267.122g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
90.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9  
Properties