Home Carbonyls methyl 4-(1-(tert-butoxycarbonyl)ethyl)benzoate

methyl 4-(1-(tert-butoxycarbonyl)ethyl)benzoate

CAS No.:
1211572-02-9
Catalog Number:
AG009YF5
Molecular Formula:
C15H21NO4
Molecular Weight:
279.3315
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Product Description
Catalog Number:
AG009YF5
Chemical Name:
methyl 4-(1-(tert-butoxycarbonyl)ethyl)benzoate
CAS Number:
1211572-02-9
Molecular Formula:
C15H21NO4
Molecular Weight:
279.3315
MDL Number:
MFCD24532698
IUPAC Name:
methyl 4-[1-[(2-methylpropan-2-yl)oxycarbonylamino]ethyl]benzoate
InChI:
InChI=1S/C15H21NO4/c1-10(16-14(18)20-15(2,3)4)11-6-8-12(9-7-11)13(17)19-5/h6-10H,1-5H3,(H,16,18)
InChI Key:
LFNXGVQOIUBOOG-UHFFFAOYSA-N
SMILES:
COC(=O)c1ccc(cc1)C(NC(=O)OC(C)(C)C)C
Properties
Complexity:
340  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
279.147g/mol
Formal Charge:
0
Heavy Atom Count:
20  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
279.336g/mol
Monoisotopic Mass:
279.147g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
64.6A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7  
Properties