Home Other Building Blocks tert-butyl 3-carbamoylpropanoate

tert-butyl 3-carbamoylpropanoate

CAS No.:
1379368-75-8
Catalog Number:
AG01C3XJ
Molecular Formula:
C8H15NO3
Molecular Weight:
173.2096
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Product Description
Catalog Number:
AG01C3XJ
Chemical Name:
tert-butyl 3-carbamoylpropanoate
CAS Number:
1379368-75-8
Molecular Formula:
C8H15NO3
Molecular Weight:
173.2096
MDL Number:
MFCD20724238
IUPAC Name:
tert-butyl 4-amino-4-oxobutanoate
InChI:
InChI=1S/C8H15NO3/c1-8(2,3)12-7(11)5-4-6(9)10/h4-5H2,1-3H3,(H2,9,10)
InChI Key:
DOFXZXIPZBUHDL-UHFFFAOYSA-N
SMILES:
O=C(OC(C)(C)C)CCC(=O)N
Properties
Complexity:
181  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
173.105g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
173.212g/mol
Monoisotopic Mass:
173.105g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
69.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.1  
Properties