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201292-99-1

201292-99-1 | L-Tyrosine, N-acetyl-O-(1,1-dimethylethyl)-

CAS No: 201292-99-1 Catalog No: AG002DBJ MDL No:MFCD00236772

Product Description

Catalog Number:
AG002DBJ
Chemical Name:
L-Tyrosine, N-acetyl-O-(1,1-dimethylethyl)-
CAS Number:
201292-99-1
Molecular Formula:
C15H21NO4
Molecular Weight:
279.3315
MDL Number:
MFCD00236772
IUPAC Name:
(2S)-2-acetamido-3-[4-[(2-methylpropan-2-yl)oxy]phenyl]propanoic acid
InChI:
InChI=1S/C15H21NO4/c1-10(17)16-13(14(18)19)9-11-5-7-12(8-6-11)20-15(2,3)4/h5-8,13H,9H2,1-4H3,(H,16,17)(H,18,19)/t13-/m0/s1
InChI Key:
JLNUTWJSFBIAAS-ZDUSSCGKSA-N
SMILES:
CC(=O)N[C@H](C(=O)O)Cc1ccc(cc1)OC(C)(C)C

Properties

Complexity:
340  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
1  
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:
2  
Isotope Atom Count:
0
Molecular Weight:
279.336g/mol
Monoisotopic Mass:
279.147g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
75.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1  

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