Home Other Building Blocks 1-[(5-fluoro-2-methoxyphenyl)methyl]piperazine

1-[(5-fluoro-2-methoxyphenyl)methyl]piperazine

CAS No.:
523980-75-8
Catalog Number:
AG019NWK
Molecular Formula:
C12H17FN2O
Molecular Weight:
224.2746
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Product Description
Catalog Number:
AG019NWK
Chemical Name:
1-[(5-fluoro-2-methoxyphenyl)methyl]piperazine
CAS Number:
523980-75-8
Molecular Formula:
C12H17FN2O
Molecular Weight:
224.2746
MDL Number:
MFCD05189170
IUPAC Name:
1-[(5-fluoro-2-methoxyphenyl)methyl]piperazine
InChI:
InChI=1S/C12H17FN2O/c1-16-12-3-2-11(13)8-10(12)9-15-6-4-14-5-7-15/h2-3,8,14H,4-7,9H2,1H3
InChI Key:
WSVHAGDWEZZIGZ-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1CN1CCNCC1)F
Properties
Complexity:
209  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
224.132g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
224.279g/mol
Monoisotopic Mass:
224.132g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
24.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2  
Properties