Home Other Building Blocks [3-(1H-PYRAZOL-1-YL)BENZYL]AMINE DIHYDROCHLORIDE

[3-(1H-PYRAZOL-1-YL)BENZYL]AMINE DIHYDROCHLORIDE

CAS No.:
1185298-57-0
Catalog Number:
AG01EJ7O
Molecular Formula:
C10H13Cl2N3
Molecular Weight:
246.1363
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Product Description
Catalog Number:
AG01EJ7O
Chemical Name:
[3-(1H-PYRAZOL-1-YL)BENZYL]AMINE DIHYDROCHLORIDE
CAS Number:
1185298-57-0
Molecular Formula:
C10H13Cl2N3
Molecular Weight:
246.1363
MDL Number:
MFCD06801241
IUPAC Name:
(3-pyrazol-1-ylphenyl)methanamine;dihydrochloride
InChI:
InChI=1S/C10H11N3.2ClH/c11-8-9-3-1-4-10(7-9)13-6-2-5-12-13;;/h1-7H,8,11H2;2*1H
InChI Key:
SGXHALBNLDWWKE-UHFFFAOYSA-N
SMILES:
NCc1cccc(c1)n1cccn1.Cl.Cl
Properties
Complexity:
160  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
245.049g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
246.135g/mol
Monoisotopic Mass:
245.049g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
43.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties