Home Aminos 4-(aminomethyl)-5-methyl-2,4-dihydro-3H-pyrazol-3-one dihydrochloride

4-(aminomethyl)-5-methyl-2,4-dihydro-3H-pyrazol-3-one dihydrochloride

CAS No.:
1609406-66-7
Catalog Number:
AG00J0YI
Molecular Formula:
C5H11Cl2N3O
Molecular Weight:
200.0663
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$168
- +
5g
95%
In Stock USA
United States
$444
- +
Product Description
Catalog Number:
AG00J0YI
Chemical Name:
4-(aminomethyl)-5-methyl-2,4-dihydro-3H-pyrazol-3-one dihydrochloride
CAS Number:
1609406-66-7
Molecular Formula:
C5H11Cl2N3O
Molecular Weight:
200.0663
MDL Number:
MFCD26959437
IUPAC Name:
4-(aminomethyl)-3-methyl-1,4-dihydropyrazol-5-one;dihydrochloride
InChI:
InChI=1S/C5H9N3O.2ClH/c1-3-4(2-6)5(9)8-7-3;;/h4H,2,6H2,1H3,(H,8,9);2*1H
InChI Key:
HTOVBJRRWXLYQB-UHFFFAOYSA-N
SMILES:
NCC1C(=NNC1=O)C.Cl.Cl
Properties
Complexity:
164  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
199.028g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
4  
Isotope Atom Count:
0
Molecular Weight:
200.063g/mol
Monoisotopic Mass:
199.028g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
67.5A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
Properties