Home Other Building Blocks 2-[(5-methylfuran-2-yl)methyl]-2,3-dihydro-1H-pyrazol-3-imine hydrochloride

2-[(5-methylfuran-2-yl)methyl]-2,3-dihydro-1H-pyrazol-3-imine hydrochloride

CAS No.:
1955505-95-9
Catalog Number:
AG01A9RX
Molecular Formula:
C9H12ClN3O
Molecular Weight:
213.6641
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Product Description
Catalog Number:
AG01A9RX
Chemical Name:
2-[(5-methylfuran-2-yl)methyl]-2,3-dihydro-1H-pyrazol-3-imine hydrochloride
CAS Number:
1955505-95-9
Molecular Formula:
C9H12ClN3O
Molecular Weight:
213.6641
MDL Number:
MFCD23145021
IUPAC Name:
2-[(5-methylfuran-2-yl)methyl]pyrazol-3-amine;hydrochloride
InChI:
InChI=1S/C9H11N3O.ClH/c1-7-2-3-8(13-7)6-12-9(10)4-5-11-12;/h2-5H,6,10H2,1H3;1H
InChI Key:
SRHJJPHZZXKIMS-UHFFFAOYSA-N
SMILES:
Cc1ccc(o1)Cn1[nH]ccc1=N.Cl
Properties
Complexity:
176  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
213.067g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
213.665g/mol
Monoisotopic Mass:
213.067g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
57A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties