Home Aminos tert-butyl 2-(4-amino-1H-pyrazol-1-yl)acetate

tert-butyl 2-(4-amino-1H-pyrazol-1-yl)acetate

CAS No.:
786684-63-7
Catalog Number:
AG01C4GE
Molecular Formula:
C9H15N3O2
Molecular Weight:
197.2343
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Product Description
Catalog Number:
AG01C4GE
Chemical Name:
tert-butyl 2-(4-amino-1H-pyrazol-1-yl)acetate
CAS Number:
786684-63-7
Molecular Formula:
C9H15N3O2
Molecular Weight:
197.2343
MDL Number:
MFCD14620166
IUPAC Name:
tert-butyl 2-(4-aminopyrazol-1-yl)acetate
InChI:
InChI=1S/C9H15N3O2/c1-9(2,3)14-8(13)6-12-5-7(10)4-11-12/h4-5H,6,10H2,1-3H3
InChI Key:
FCEYZRUTRMWATR-UHFFFAOYSA-N
SMILES:
O=C(Cn1ncc(c1)N)OC(C)(C)C
Properties
Complexity:
213  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
197.116g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
197.238g/mol
Monoisotopic Mass:
197.116g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
70.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6  
Properties