Home Aminos 4-amino-2,3-dihydro-1H-pyrazol-3-one dihydrochloride

4-amino-2,3-dihydro-1H-pyrazol-3-one dihydrochloride

CAS No.:
1808683-31-9
Catalog Number:
AG01AM73
Molecular Formula:
C3H7Cl2N3O
Molecular Weight:
172.0132
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Product Description
Catalog Number:
AG01AM73
Chemical Name:
4-amino-2,3-dihydro-1H-pyrazol-3-one dihydrochloride
CAS Number:
1808683-31-9
Molecular Formula:
C3H7Cl2N3O
Molecular Weight:
172.0132
MDL Number:
MFCD29033890
IUPAC Name:
4-amino-1,2-dihydropyrazol-3-one;dihydrochloride
InChI:
InChI=1S/C3H5N3O.2ClH/c4-2-1-5-6-3(2)7;;/h1H,4H2,(H2,5,6,7);2*1H
InChI Key:
OWKKTEALCNOAHT-UHFFFAOYSA-N
SMILES:
O=c1[nH][nH]cc1N.Cl.Cl
Properties
Complexity:
128  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
170.997g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
5  
Isotope Atom Count:
0
Molecular Weight:
172.009g/mol
Monoisotopic Mass:
170.997g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
67.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties