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1219382-08-7

1219382-08-7 | Tyrosine, N-acetyl-2,6-dimethyl-O-(phenylmethyl)-

CAS No: 1219382-08-7 Catalog No: AG0016FQ MDL No:

Product Description

Catalog Number:
AG0016FQ
Chemical Name:
Tyrosine, N-acetyl-2,6-dimethyl-O-(phenylmethyl)-
CAS Number:
1219382-08-7
Molecular Formula:
C20H23NO4
Molecular Weight:
341.4009
IUPAC Name:
2-acetamido-3-(2,6-dimethyl-4-phenylmethoxyphenyl)propanoic acid
InChI:
InChI=1S/C20H23NO4/c1-13-9-17(25-12-16-7-5-4-6-8-16)10-14(2)18(13)11-19(20(23)24)21-15(3)22/h4-10,19H,11-12H2,1-3H3,(H,21,22)(H,23,24)
InChI Key:
TXJBSJQFIDGTKK-UHFFFAOYSA-N
SMILES:
CC(=O)N[C@H](C(=O)O)Cc1c(C)cc(cc1C)OCc1ccccc1

Properties

Complexity:
435  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
341.163g/mol
Formal Charge:
0
Heavy Atom Count:
25  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
341.407g/mol
Monoisotopic Mass:
341.163g/mol
Rotatable Bond Count:
7  
Topological Polar Surface Area:
75.6A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3  

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