Home Carbonyls methyl 3-{[(tert-butoxy)carbonyl](methyl)amino}-2-(hydroxymethyl)propanoate

methyl 3-{[(tert-butoxy)carbonyl](methyl)amino}-2-(hydroxymethyl)propanoate

CAS No.:
119740-96-4
Catalog Number:
AG01BAWT
Molecular Formula:
C11H21NO5
Molecular Weight:
247.2881
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Product Description
Catalog Number:
AG01BAWT
Chemical Name:
methyl 3-{[(tert-butoxy)carbonyl](methyl)amino}-2-(hydroxymethyl)propanoate
CAS Number:
119740-96-4
Molecular Formula:
C11H21NO5
Molecular Weight:
247.2881
MDL Number:
MFCD24472047
IUPAC Name:
methyl 2-(hydroxymethyl)-3-[methyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]propanoate
InChI:
InChI=1S/C11H21NO5/c1-11(2,3)17-10(15)12(4)6-8(7-13)9(14)16-5/h8,13H,6-7H2,1-5H3
InChI Key:
KUNOSIAOXSNNTF-UHFFFAOYSA-N
SMILES:
OCC(C(=O)OC)CN(C(=O)OC(C)(C)C)C
Properties
Complexity:
272  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
247.142g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
247.291g/mol
Monoisotopic Mass:
247.142g/mol
Rotatable Bond Count:
7  
Topological Polar Surface Area:
76.1A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
0.3  
Properties