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

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

CAS No.:
923204-69-7
Catalog Number:
AG019K5O
Molecular Formula:
C10H11F2N3
Molecular Weight:
211.2112
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Product Description
Catalog Number:
AG019K5O
Chemical Name:
1-[1-(difluoromethyl)-1H-1,3-benzodiazol-2-yl]ethan-1-amine
CAS Number:
923204-69-7
Molecular Formula:
C10H11F2N3
Molecular Weight:
211.2112
MDL Number:
MFCD08444436
IUPAC Name:
1-[1-(difluoromethyl)benzimidazol-2-yl]ethanamine
InChI:
InChI=1S/C10H11F2N3/c1-6(13)9-14-7-4-2-3-5-8(7)15(9)10(11)12/h2-6,10H,13H2,1H3
InChI Key:
IIYRQEHOCIXDBN-UHFFFAOYSA-N
SMILES:
CC(c1nc2c(n1C(F)F)cccc2)N
Properties
Complexity:
225  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
211.092g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
211.216g/mol
Monoisotopic Mass:
211.092g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
43.8A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6  
Properties