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883555-08-6 | Methyl 4-((tert-butoxycarbonyl);amino);-2-methoxybenzoate
CAS No: 883555-08-6 Catalog No: AG0045OW MDL No:
Product Description
Catalog Number:
AG0045OW
Chemical Name:
Methyl 4-((tert-butoxycarbonyl);amino);-2-methoxybenzoate
CAS Number:
883555-08-6
Molecular Formula:
C14H19NO5
Molecular Weight:
281.3044
IUPAC Name:
methyl 2-methoxy-4-[(2-methylpropan-2-yl)oxycarbonylamino]benzoate
InChI:
InChI=1S/C14H19NO5/c1-14(2,3)20-13(17)15-9-6-7-10(12(16)19-5)11(8-9)18-4/h6-8H,1-5H3,(H,15,17)
InChI Key:
VJJUWMAJRNOUSD-UHFFFAOYSA-N
SMILES:
COC(=O)c1ccc(cc1OC)NC(=O)OC(C)(C)C
Properties
Complexity:
350
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
281.126g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
281.308g/mol
Monoisotopic Mass:
281.126g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
73.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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