Molecule structure of 3-Chloro-L-tyrosine (CAS NO.7423-93-0) :
IUPAC Name: (2S)-2-amino-3-(3-chloro-4-hydroxyphenyl)propanoic acid
Molecular Weight: 215.6336 g/mol
Molecular Formula: C9H10ClNO3
Density: 1.458 g/cm3
Melting Point: 249 °C(lit.)
Boiling Point: 388.6 °C at 760 mmHg
Flash Point: 188.8 °C
Molar Volume: 147.8 cm3
Polarizability: 20.72*10-24 cm3
Surface Tension: 66.8 dyne/cm
Enthalpy of Vaporization: 67.27 kJ/mol
Vapour Pressure: 9.81E-07 mmHg at 25 °C
Alpha: -2 ° (c=1 in 1 M HCl)
Storage temp.: store at RT
XLogP3: -1.8
H-Bond Donor: 3
H-Bond Acceptor: 4
Rotatable Bond Count: 3
Tautomer Count: 3
Exact Mass: 215.034921
MonoIsotopic Mass: 215.034921
Topological Polar Surface Area: 83.6
Heavy Atom Count: 14
Complexity: 212
Defined Atom StereoCenter Count: 1
Canonical SMILES: C1=CC(=C(C=C1CC(C(=O)O)N)Cl)O
Isomeric SMILES: C1=CC(=C(C=C1C[C@@H](C(=O)O)N)Cl)O
InChI: InChI=1S/C9H10ClNO3/c10-6-3-5(1-2-8(6)12)4-7(11)9(13)14/h1-3,7,12H,4,11H2,(H,13,14)/t7-/m0/s1
InChIKey: ACWBBAGYTKWBCD-ZETCQYMHSA-N
EINECS: 231-050-3
Product Categories of 3-Chloro-L-tyrosine (CAS NO.7423-93-0) : PROTECTED AMINO ACID & PEPTIDES; Tyrosine [Tyr, Y]; Unusual Amino Acids; Peptide Synthesis; Tyrosine Derivatives; Unnatural Amino Acid Derivatives
Safety Statements: 22-24/25
S22: Do not breathe dust
S24/25: Avoid contact with skin and eyes
WGK Germany: 3
3-Chloro-L-tyrosine (CAS NO.7423-93-0) is also called H-Tyr(3-Cl)-OH ; H-3-Chloro-L-tyr-OH ; Chloro-L-tyrosine, 3- ; 3-Chlorotyrosine ; 3-Chloro-4-hydroxy-L-phenylalanine~H-Tyr(3-Cl)-OH ; 3-Chloro-L-Tyrosine,>97% .
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