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144991-25-3 | 1H-Pyrazole-1-acetic acid, 5-amino-
CAS No: 144991-25-3 Catalog No: AG001KF5 MDL No:MFCD18307167
Product Description
Catalog Number:
AG001KF5
Chemical Name:
1H-Pyrazole-1-acetic acid, 5-amino-
CAS Number:
144991-25-3
Molecular Formula:
C5H7N3O2
Molecular Weight:
141.1280
MDL Number:
MFCD18307167
IUPAC Name:
2-(5-aminopyrazol-1-yl)acetic acid
InChI:
InChI=1S/C5H7N3O2/c6-4-1-2-7-8(4)3-5(9)10/h1-2H,3,6H2,(H,9,10)
InChI Key:
QXGNFPJNGTWWAB-UHFFFAOYSA-N
SMILES:
OC(=O)Cn1nccc1N
Properties
Complexity:
139
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
141.054g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
141.13g/mol
Monoisotopic Mass:
141.054g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
81.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.4
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