Home Aminos methyl 2-amino-3-(4-methyl-1H-pyrazol-1-yl)propanoate dihydrochloride

methyl 2-amino-3-(4-methyl-1H-pyrazol-1-yl)propanoate dihydrochloride

CAS No.:
2137566-97-1
Catalog Number:
AG01EI9Z
Molecular Formula:
C8H15Cl2N3O2
Molecular Weight:
256.1296
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Product Description
Catalog Number:
AG01EI9Z
Chemical Name:
methyl 2-amino-3-(4-methyl-1H-pyrazol-1-yl)propanoate dihydrochloride
CAS Number:
2137566-97-1
Molecular Formula:
C8H15Cl2N3O2
Molecular Weight:
256.1296
MDL Number:
MFCD31558974
IUPAC Name:
methyl 2-amino-3-(4-methylpyrazol-1-yl)propanoate;dihydrochloride
InChI:
InChI=1S/C8H13N3O2.2ClH/c1-6-3-10-11(4-6)5-7(9)8(12)13-2;;/h3-4,7H,5,9H2,1-2H3;2*1H
InChI Key:
JPNSLJLDGYIWRI-UHFFFAOYSA-N
SMILES:
COC(=O)C(Cn1ncc(c1)C)N.Cl.Cl
Properties
Complexity:
186  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
255.054g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
256.127g/mol
Monoisotopic Mass:
255.054g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
70.1A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
Properties