Home Carbonyls Benzeneacetic acid, α-[[(1,1-dimethylethoxy)carbonyl]amino]-2-methoxy-

Benzeneacetic acid, α-[[(1,1-dimethylethoxy)carbonyl]amino]-2-methoxy-

CAS No.:
179417-69-7
Catalog Number:
AG002708
Molecular Formula:
C14H19NO5
Molecular Weight:
281.3044
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Product Description
Catalog Number:
AG002708
Chemical Name:
Benzeneacetic acid, α-[[(1,1-dimethylethoxy)carbonyl]amino]-2-methoxy-
CAS Number:
179417-69-7
Molecular Formula:
C14H19NO5
Molecular Weight:
281.3044
MDL Number:
MFCD06797221
IUPAC Name:
2-(2-methoxyphenyl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]acetic acid
InChI:
InChI=1S/C14H19NO5/c1-14(2,3)20-13(18)15-11(12(16)17)9-7-5-6-8-10(9)19-4/h5-8,11H,1-4H3,(H,15,18)(H,16,17)
InChI Key:
KRHZKJYHTQGZGS-UHFFFAOYSA-N
SMILES:
COc1ccccc1C(C(=O)O)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:
2  
Isotope Atom Count:
0
Molecular Weight:
281.308g/mol
Monoisotopic Mass:
281.126g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
84.9A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2  
Properties