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23279-22-3 | L-Tyrosine, 3-amino-, dihydrochloride (9CI)
CAS No: 23279-22-3 Catalog No: AG002MQO MDL No:MFCD00012964
Product Description
Catalog Number:
AG002MQO
Chemical Name:
L-Tyrosine, 3-amino-, dihydrochloride (9CI)
CAS Number:
23279-22-3
Molecular Formula:
C9H14Cl2N2O3
Molecular Weight:
269.1251
MDL Number:
MFCD00012964
IUPAC Name:
(2S)-2-amino-3-(3-amino-4-hydroxyphenyl)propanoic acid;dihydrochloride
InChI:
InChI=1S/C9H12N2O3.2ClH/c10-6-3-5(1-2-8(6)12)4-7(11)9(13)14;;/h1-3,7,12H,4,10-11H2,(H,13,14);2*1H/t7-;;/m0../s1
InChI Key:
PIFWBMTWCTUOOQ-KLXURFKVSA-N
SMILES:
OC(=O)[C@H](Cc1ccc(c(c1)N)O)N.Cl.Cl
EC Number:
245-552-5
Properties
Complexity:
210
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
268.038g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
6
Isotope Atom Count:
0
Molecular Weight:
269.122g/mol
Monoisotopic Mass:
268.038g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
110A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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