Home Other Building Blocks 2-[1-(difluoromethyl)-1H-1,3-benzodiazol-2-yl]ethan-1-amine dihydrochloride

2-[1-(difluoromethyl)-1H-1,3-benzodiazol-2-yl]ethan-1-amine dihydrochloride

CAS No.:
1311316-58-1
Catalog Number:
AG01AHJW
Molecular Formula:
C10H13Cl2F2N3
Molecular Weight:
284.1331
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Product Description
Catalog Number:
AG01AHJW
Chemical Name:
2-[1-(difluoromethyl)-1H-1,3-benzodiazol-2-yl]ethan-1-amine dihydrochloride
CAS Number:
1311316-58-1
Molecular Formula:
C10H13Cl2F2N3
Molecular Weight:
284.1331
MDL Number:
MFCD18785499
IUPAC Name:
2-[1-(difluoromethyl)benzimidazol-2-yl]ethanamine;dihydrochloride
InChI:
InChI=1S/C10H11F2N3.2ClH/c11-10(12)15-8-4-2-1-3-7(8)14-9(15)5-6-13;;/h1-4,10H,5-6,13H2;2*1H
InChI Key:
IXCJHJTXUVZCRJ-UHFFFAOYSA-N
SMILES:
NCCc1nc2c(n1C(F)F)cccc2.Cl.Cl
Properties
Complexity:
213  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
283.045g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
284.132g/mol
Monoisotopic Mass:
283.045g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
43.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties