Home Carboxys 1-[(tert-butoxy)carbonyl]-3-(prop-2-en-1-yl)azetidine-3-carboxylic acid

1-[(tert-butoxy)carbonyl]-3-(prop-2-en-1-yl)azetidine-3-carboxylic acid

CAS No.:
1936583-41-3
Catalog Number:
AG01BJ0L
Molecular Formula:
C12H19NO4
Molecular Weight:
241.2836
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Product Description
Catalog Number:
AG01BJ0L
Chemical Name:
1-[(tert-butoxy)carbonyl]-3-(prop-2-en-1-yl)azetidine-3-carboxylic acid
CAS Number:
1936583-41-3
Molecular Formula:
C12H19NO4
Molecular Weight:
241.2836
MDL Number:
MFCD30751463
IUPAC Name:
1-[(2-methylpropan-2-yl)oxycarbonyl]-3-prop-2-enylazetidine-3-carboxylic acid
InChI:
InChI=1S/C12H19NO4/c1-5-6-12(9(14)15)7-13(8-12)10(16)17-11(2,3)4/h5H,1,6-8H2,2-4H3,(H,14,15)
InChI Key:
RYVFABKHPULMNH-UHFFFAOYSA-N
SMILES:
C=CCC1(CN(C1)C(=O)OC(C)(C)C)C(=O)O
Properties
Complexity:
337  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
241.131g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
241.287g/mol
Monoisotopic Mass:
241.131g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
66.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3  
Properties