Home Carbonyls 2-{[(tert-butoxy)carbonyl]amino}-2-(2,4,6-trimethylphenyl)acetic acid

2-{[(tert-butoxy)carbonyl]amino}-2-(2,4,6-trimethylphenyl)acetic acid

CAS No.:
1404638-84-1
Catalog Number:
AG01EKHL
Molecular Formula:
C16H23NO4
Molecular Weight:
293.3581
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Product Description
Catalog Number:
AG01EKHL
Chemical Name:
2-{[(tert-butoxy)carbonyl]amino}-2-(2,4,6-trimethylphenyl)acetic acid
CAS Number:
1404638-84-1
Molecular Formula:
C16H23NO4
Molecular Weight:
293.3581
MDL Number:
MFCD07388920
IUPAC Name:
2-[(2-methylpropan-2-yl)oxycarbonylamino]-2-(2,4,6-trimethylphenyl)acetic acid
InChI:
InChI=1S/C16H23NO4/c1-9-7-10(2)12(11(3)8-9)13(14(18)19)17-15(20)21-16(4,5)6/h7-8,13H,1-6H3,(H,17,20)(H,18,19)
InChI Key:
IGJRSXKWHUKWOW-UHFFFAOYSA-N
SMILES:
O=C(OC(C)(C)C)NC(c1c(C)cc(cc1C)C)C(=O)O
Properties
Complexity:
376  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
293.163g/mol
Formal Charge:
0
Heavy Atom Count:
21  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
293.363g/mol
Monoisotopic Mass:
293.163g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
75.6A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3  
Properties