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

methyl 3-(3-amino-1H-pyrazol-1-yl)propanoate

CAS No.:
1342251-94-8
Catalog Number:
AG01EI8T
Molecular Formula:
C7H11N3O2
Molecular Weight:
169.1811
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Product Description
Catalog Number:
AG01EI8T
Chemical Name:
methyl 3-(3-amino-1H-pyrazol-1-yl)propanoate
CAS Number:
1342251-94-8
Molecular Formula:
C7H11N3O2
Molecular Weight:
169.1811
MDL Number:
MFCD19612266
IUPAC Name:
methyl 3-(3-aminopyrazol-1-yl)propanoate
InChI:
InChI=1S/C7H11N3O2/c1-12-7(11)3-5-10-4-2-6(8)9-10/h2,4H,3,5H2,1H3,(H2,8,9)
InChI Key:
IIBMBKSLTKHWSZ-UHFFFAOYSA-N
SMILES:
COC(=O)CCn1ccc(n1)N
Properties
Complexity:
163  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
169.085g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
169.184g/mol
Monoisotopic Mass:
169.085g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
70.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.4  
Properties