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Home >> Chemical Listing >> Page 1648 >> 3-(1,3-Benzothiazol-2-Yl)Alanine

3-(1,3-Benzothiazol-2-Yl)Alanine
[CAS# 497097-56-0]

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Identification
Name 3-(1,3-Benzothiazol-2-Yl)Alanine
Synonyms 2-amino-3-(benzo[d]thiazol-2-yl)propanoic acid; 3-(1,3-Benzothiazol-2-yl)-D-alanine; 3-(2-benzothiazolyl)alanine
Molecular Structure CAS#: 497097-56-0, 3-(1,3-Benzothiazol-2-Yl)Alanine
Molecular Formula C10H10N2O2S
Molecular Weight 222.26
CAS Registry Number 497097-56-0
SMILES OC(=O)C(N)Cc1nc2ccccc2s1
InChI 1S/C10H10N2O2S/c11-6(10(13)14)5-9-12-7-3-1-2-4-8(7)15-9/h1-4,6H,5,11H2,(H,13,14)
InChIKey DNDVHMGBCGSRIY-UHFFFAOYSA-N
Properties
Density 1.441g/cm3 (Cal.)
Boiling point 419.509°C at 760 mmHg (Cal.)
Flash point 207.512°C (Cal.)
Refractive index 1.703 (Cal.)
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