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3,5-Dichloro-2-methoxyphenylalanine

HCID 3957680
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Basic information

CAS
603105-81-3
Standard SMILES
COc1c(Cl)cc(Cl)cc1CC(N)C(=O)O
InChIKey
BGINKMZWWAAZDA-UHFFFAOYSA-N
Molecular formula
C10H11Cl2NO3
Average molar mass
264.1 g/mol
Monoisotopic mass
263.01159857

Names & identifiers

Preferred name
3,5-Dichloro-2-methoxyphenylalanine
IUPAC
2-amino-3-(3,5-dichloro-2-methoxyphenyl)propanoic acid

Names & synonyms

3,5-dichloro-2-methoxyphenylalanineDTXSID801292842603105-81-3

Database identifiers

CAS
603105-81-3
PubChem CID
3957680
DTXSID
DTXSID801292842

Properties

Computed structural properties

XLogP
-0.2
Topological polar surface area
72.6 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
4
Rotatable bonds
4
Heavy atoms
16
Formal charge
0
Complexity
252

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Compound notes

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