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16879-89-3 | L-Tyrosine, O-(1,1-dimethylethyl)-N-[(phenylmethoxy)carbonyl]-,(4-nitrophenyl)methyl ester
CAS No: 16879-89-3 Catalog No: AG00HZ93 MDL No:MFCD00270509
Product Description
Catalog Number:
AG00HZ93
Chemical Name:
L-Tyrosine, O-(1,1-dimethylethyl)-N-[(phenylmethoxy)carbonyl]-,(4-nitrophenyl)methyl ester
CAS Number:
16879-89-3
MDL Number:
MFCD00270509
IUPAC Name:
(4-nitrophenyl)methyl (2S)-3-[4-[(2-methylpropan-2-yl)oxy]phenyl]-2-(phenylmethoxycarbonylamino)propanoate
InChI:
InChI=1S/C28H30N2O7/c1-28(2,3)37-24-15-11-20(12-16-24)17-25(29-27(32)36-19-21-7-5-4-6-8-21)26(31)35-18-22-9-13-23(14-10-22)30(33)34/h4-16,25H,17-19H2,1-3H3,(H,29,32)/t25-/m0/s1
InChI Key:
IPXKPWMYSGJBGM-VWLOTQADSA-N
Properties
Complexity:
726
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
506.205g/mol
Formal Charge:
0
Heavy Atom Count:
37
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
506.555g/mol
Monoisotopic Mass:
506.205g/mol
Rotatable Bond Count:
12
Topological Polar Surface Area:
120A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.6
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