Home Other Building Blocks 4-fluoro-2-(prop-2-yn-1-yloxy)aniline hydrochloride

4-fluoro-2-(prop-2-yn-1-yloxy)aniline hydrochloride

CAS No.:
1354950-12-1
Catalog Number:
AG01AKU7
Molecular Formula:
C9H9ClFNO
Molecular Weight:
201.6253
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Product Description
Catalog Number:
AG01AKU7
Chemical Name:
4-fluoro-2-(prop-2-yn-1-yloxy)aniline hydrochloride
CAS Number:
1354950-12-1
Molecular Formula:
C9H9ClFNO
Molecular Weight:
201.6253
MDL Number:
MFCD20233589
IUPAC Name:
4-fluoro-2-prop-2-ynoxyaniline;hydrochloride
InChI:
InChI=1S/C9H8FNO.ClH/c1-2-5-12-9-6-7(10)3-4-8(9)11;/h1,3-4,6H,5,11H2;1H
InChI Key:
FZKVYBFPAHBKGE-UHFFFAOYSA-N
SMILES:
Nc1ccc(cc1OCC#C)F.Cl
Properties
Complexity:
186  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
201.036g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
201.625g/mol
Monoisotopic Mass:
201.036g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
35.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties