Home Other Building Blocks 1-(4-fluorophenyl)-N-methylbut-3-yn-2-amine

1-(4-fluorophenyl)-N-methylbut-3-yn-2-amine

CAS No.:
1498745-59-7
Catalog Number:
AG01DVEP
Molecular Formula:
C11H12FN
Molecular Weight:
177.2181
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Product Description
Catalog Number:
AG01DVEP
Chemical Name:
1-(4-fluorophenyl)-N-methylbut-3-yn-2-amine
CAS Number:
1498745-59-7
Molecular Formula:
C11H12FN
Molecular Weight:
177.2181
MDL Number:
MFCD21263376
IUPAC Name:
1-(4-fluorophenyl)-N-methylbut-3-yn-2-amine
InChI:
InChI=1S/C11H12FN/c1-3-11(13-2)8-9-4-6-10(12)7-5-9/h1,4-7,11,13H,8H2,2H3
InChI Key:
HYWXCLRTOPARFL-UHFFFAOYSA-N
SMILES:
CNC(Cc1ccc(cc1)F)C#C
Properties
Complexity:
186  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
177.095g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
177.222g/mol
Monoisotopic Mass:
177.095g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
12A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2  
Properties