Home Carboxys N-Boc-3-ethylmorpholine-3-carboxylic Acid

N-Boc-3-ethylmorpholine-3-carboxylic Acid

CAS No.:
1205749-44-5
Catalog Number:
AG003ST7
Molecular Formula:
C12H21NO5
Molecular Weight:
259.2988
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Product Description
Catalog Number:
AG003ST7
Chemical Name:
N-Boc-3-ethylmorpholine-3-carboxylic Acid
CAS Number:
1205749-44-5
Molecular Formula:
C12H21NO5
Molecular Weight:
259.2988
MDL Number:
MFCD14582558
IUPAC Name:
3-ethyl-4-[(2-methylpropan-2-yl)oxycarbonyl]morpholine-3-carboxylic acid
InChI:
InChI=1S/C12H21NO5/c1-5-12(9(14)15)8-17-7-6-13(12)10(16)18-11(2,3)4/h5-8H2,1-4H3,(H,14,15)
InChI Key:
SOHNOCHHIWUYFV-UHFFFAOYSA-N
SMILES:
CCC1(COCCN1C(=O)OC(C)(C)C)C(=O)O
Properties
Complexity:
336  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
259.142g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
259.302g/mol
Monoisotopic Mass:
259.142g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
76.1A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1  
Properties