Home Halogens 2-amino-3-(4-bromo-1H-pyrazol-1-yl)propanoic acid hydrochloride

2-amino-3-(4-bromo-1H-pyrazol-1-yl)propanoic acid hydrochloride

CAS No.:
1461704-61-9
Catalog Number:
AG01A6I4
Molecular Formula:
C6H9BrClN3O2
Molecular Weight:
270.5116
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Product Description
Catalog Number:
AG01A6I4
Chemical Name:
2-amino-3-(4-bromo-1H-pyrazol-1-yl)propanoic acid hydrochloride
CAS Number:
1461704-61-9
Molecular Formula:
C6H9BrClN3O2
Molecular Weight:
270.5116
MDL Number:
MFCD25371834
IUPAC Name:
2-amino-3-(4-bromopyrazol-1-yl)propanoic acid;hydrochloride
InChI:
InChI=1S/C6H8BrN3O2.ClH/c7-4-1-9-10(2-4)3-5(8)6(11)12;/h1-2,5H,3,8H2,(H,11,12);1H
InChI Key:
SXPCSCUDXNSDJM-UHFFFAOYSA-N
SMILES:
NC(C(=O)O)Cn1cc(cn1)Br.Cl
Properties
Complexity:
178  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
268.957g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
270.511g/mol
Monoisotopic Mass:
268.957g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
81.1A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
Properties