Home Other Building Blocks {[1-(difluoromethyl)-1H-imidazol-2-yl]methyl}(methyl)amine

{[1-(difluoromethyl)-1H-imidazol-2-yl]methyl}(methyl)amine

CAS No.:
929972-67-8
Catalog Number:
AG019LB0
Molecular Formula:
C6H9F2N3
Molecular Weight:
161.1526
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Product Description
Catalog Number:
AG019LB0
Chemical Name:
{[1-(difluoromethyl)-1H-imidazol-2-yl]methyl}(methyl)amine
CAS Number:
929972-67-8
Molecular Formula:
C6H9F2N3
Molecular Weight:
161.1526
MDL Number:
MFCD09040727
IUPAC Name:
1-[1-(difluoromethyl)imidazol-2-yl]-N-methylmethanamine
InChI:
InChI=1S/C6H9F2N3/c1-9-4-5-10-2-3-11(5)6(7)8/h2-3,6,9H,4H2,1H3
InChI Key:
PCACBZDNEUJGCO-UHFFFAOYSA-N
SMILES:
CNCc1nccn1C(F)F
Properties
Complexity:
120  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
161.076g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
161.156g/mol
Monoisotopic Mass:
161.076g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
29.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.3  
Properties