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3-(2-thienyl)-DL-alanine hydrochloride

HCID 20165801
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Basic information

Standard SMILES
Cl.NC(Cc1cccs1)C(=O)O
InChIKey
BKOMLSDJTRAHDX-UHFFFAOYSA-N
Molecular formula
C7H10ClNO2S
Average molar mass
207.68 g/mol

Names & identifiers

Preferred name
3-(2-thienyl)-DL-alanine hydrochloride
IUPAC
2-amino-3-thiophen-2-ylpropanoic acid;hydrochloride

Names & synonyms

(2S)-2-amino-3-(thiophen-2-yl)propanoic acid hydrochlorideSCHEMBL7382497BKOMLSDJTRAHDX-UHFFFAOYSA-N3-(2-thienyl)-DL-alanine hydrochloride2-amino-3-(2-thienyl)propanoic acid;hydrochloride

Database identifiers

PubChem CID
20165801

Properties

Computed structural propertiesFilling in

Topological polar surface area
91.6 Ų
Hydrogen bond donors
3
Hydrogen bond acceptors
4
Rotatable bonds
3
Heavy atoms
12
Formal charge
0
Complexity
151

Related reactions

1 records
New reaction record
HRID 255622 reaction equation
HRID 255622As reactantuspto-grants-1987_10

Compound notes

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