Home Halogens 1-(5,6-dichloro-1H-1,3-benzodiazol-2-yl)ethan-1-amine dihydrochloride

1-(5,6-dichloro-1H-1,3-benzodiazol-2-yl)ethan-1-amine dihydrochloride

CAS No.:
1864058-51-4
Catalog Number:
AG01C15M
Molecular Formula:
C9H11Cl4N3
Molecular Weight:
303.0157
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Product Description
Catalog Number:
AG01C15M
Chemical Name:
1-(5,6-dichloro-1H-1,3-benzodiazol-2-yl)ethan-1-amine dihydrochloride
CAS Number:
1864058-51-4
Molecular Formula:
C9H11Cl4N3
Molecular Weight:
303.0157
MDL Number:
MFCD29041291
IUPAC Name:
1-(5,6-dichloro-1H-benzimidazol-2-yl)ethanamine;dihydrochloride
InChI:
InChI=1S/C9H9Cl2N3.2ClH/c1-4(12)9-13-7-2-5(10)6(11)3-8(7)14-9;;/h2-4H,12H2,1H3,(H,13,14);2*1H
InChI Key:
UUPTWDUHEXVXHW-UHFFFAOYSA-N
SMILES:
Clc1cc2[nH]c(nc2cc1Cl)C(N)C.Cl.Cl
Properties
Complexity:
214  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
302.968g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
4  
Isotope Atom Count:
0
Molecular Weight:
303.008g/mol
Monoisotopic Mass:
300.971g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
54.7A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
Properties