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D-Tyrosine, N-(3-(4-bromophenyl)-3-oxopropyl)-, hydrochloride

HCID 3070198
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Basic information

CAS
85975-21-9
Standard SMILES
Cl.O=C(CCN[C@H](Cc1ccc(O)cc1)C(=O)O)c1ccc(Br)cc1
InChIKey
BITAHSYPRZJGEE-PKLMIRHRSA-N
Molecular formula
C18H19BrClNO4
Average molar mass
428.7 g/mol
Monoisotopic mass
427.0186

Names & identifiers

Preferred name
D-Tyrosine, N-(3-(4-bromophenyl)-3-oxopropyl)-, hydrochloride
IUPAC
(2R)-2-[[3-(4-bromophenyl)-3-oxopropyl]amino]-3-(4-hydroxyphenyl)propanoic acid;hydrochloride

Names & synonyms

D-Tyrosine, N-(3-(4-bromophenyl)-3-oxopropyl)-, hydrochlorideN-(3-(4-Bromophenyl)-3-oxopropyl)-D-tyrosine hydrochloride85975-21-9DTXSID90235309RefChem:336591DTXCID40157800N-[3-(4-Bromophenyl)-3-oxopropyl]-D-tyrosine--hydrogen chloride (1/1)

Database identifiers

CAS
85975-21-9
PubChem CID
3070198
DTXSID
DTXSID90235309

Properties

Computed structural properties

Topological polar surface area
86.6 Ų
Hydrogen bond donors
4
Hydrogen bond acceptors
5
Rotatable bonds
8
Heavy atoms
25
Formal charge
0
Complexity
415

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