Home Aminos 2-amino-3-(1H-1,3-benzodiazol-1-yl)propanoic acid hydrochloride

2-amino-3-(1H-1,3-benzodiazol-1-yl)propanoic acid hydrochloride

CAS No.:
1803570-75-3
Catalog Number:
AG01BDZ7
Molecular Formula:
C10H12ClN3O2
Molecular Weight:
241.6742
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Product Description
Catalog Number:
AG01BDZ7
Chemical Name:
2-amino-3-(1H-1,3-benzodiazol-1-yl)propanoic acid hydrochloride
CAS Number:
1803570-75-3
Molecular Formula:
C10H12ClN3O2
Molecular Weight:
241.6742
MDL Number:
MFCD28063741
IUPAC Name:
2-amino-3-(benzimidazol-1-yl)propanoic acid;hydrochloride
InChI:
InChI=1S/C10H11N3O2.ClH/c11-7(10(14)15)5-13-6-12-8-3-1-2-4-9(8)13;/h1-4,6-7H,5,11H2,(H,14,15);1H
InChI Key:
FBLFNRUJUPKWLU-UHFFFAOYSA-N
SMILES:
OC(=O)C(Cn1cnc2c1cccc2)N.Cl
Properties
Complexity:
247  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
241.062g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
241.675g/mol
Monoisotopic Mass:
241.062g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
81.1A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
Properties