CAS 136590-09-5 | L-Tyrosine, N-[(9H-fluoren-9-ylmethoxy)carbonyl]-3-nitro- | CAS Number 136590-09-5

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136590-09-5 | L-Tyrosine, N-[(9H-fluoren-9-ylmethoxy)carbonyl]-3-nitro-

CAS No: 136590-09-5 Catalog No: AG00124N MDL No:MFCD00171383

Product Description

Catalog Number:

AG00124N

Chemical Name:

L-Tyrosine, N-[(9H-fluoren-9-ylmethoxy)carbonyl]-3-nitro-

CAS Number:

136590-09-5

Molecular Formula:

C24H20N2O7

Molecular Weight:

448.4248

MDL Number:

MFCD00171383

IUPAC Name:

(2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-3-(4-hydroxy-3-nitrophenyl)propanoic acid

InChI:

InChI=1S/C24H20N2O7/c27-22-10-9-14(12-21(22)26(31)32)11-20(23(28)29)25-24(30)33-13-19-17-7-3-1-5-15(17)16-6-2-4-8-18(16)19/h1-10,12,19-20,27H,11,13H2,(H,25,30)(H,28,29)/t20-/m0/s1

InChI Key:

JZUZJVFERQWLNC-FQEVSTJZSA-N

SMILES:

O=C(N[C@H](C(=O)O)Cc1ccc(c(c1)[N+](=O)[O-])O)OCC1c2ccccc2c2c1cccc2

Properties

Complexity:

704

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

448.127g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

448.431g/mol

Monoisotopic Mass:

448.127g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

142A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

4.7

Literature

Title	Journal
Synthesis of molecularly imprinted polymers for amino acid derivates by using different functional monomers.	International journal of molecular sciences 20110101