Home Carboxys tert-Butyl 3-cyanomorpholine-4-carboxylate

tert-Butyl 3-cyanomorpholine-4-carboxylate

CAS No.:
518047-40-0
Catalog Number:
AG00D8FR
Molecular Formula:
C10H16N2O3
Molecular Weight:
212.2456
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$565
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Product Description
Catalog Number:
AG00D8FR
Chemical Name:
tert-Butyl 3-cyanomorpholine-4-carboxylate
CAS Number:
518047-40-0
Molecular Formula:
C10H16N2O3
Molecular Weight:
212.2456
MDL Number:
MFCD09863125
IUPAC Name:
tert-butyl 3-cyanomorpholine-4-carboxylate
InChI:
InChI=1S/C10H16N2O3/c1-10(2,3)15-9(13)12-4-5-14-7-8(12)6-11/h8H,4-5,7H2,1-3H3
InChI Key:
QSBSEJKNKHZYKD-UHFFFAOYSA-N
SMILES:
N#CC1COCCN1C(=O)OC(C)(C)C
Properties
Complexity:
287  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
212.116g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
212.249g/mol
Monoisotopic Mass:
212.116g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
62.6A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6  
Properties