Home Other Building Blocks 3-(4-fluoronaphthalen-1-yl)propanoic acid

3-(4-fluoronaphthalen-1-yl)propanoic acid

CAS No.:
2059956-15-7
Catalog Number:
AG01C0KH
Molecular Formula:
C13H11FO2
Molecular Weight:
218.2236
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Product Description
Catalog Number:
AG01C0KH
Chemical Name:
3-(4-fluoronaphthalen-1-yl)propanoic acid
CAS Number:
2059956-15-7
Molecular Formula:
C13H11FO2
Molecular Weight:
218.2236
MDL Number:
MFCD30498043
IUPAC Name:
3-(4-fluoronaphthalen-1-yl)propanoic acid
InChI:
InChI=1S/C13H11FO2/c14-12-7-5-9(6-8-13(15)16)10-3-1-2-4-11(10)12/h1-5,7H,6,8H2,(H,15,16)
InChI Key:
HMQMDWQIOFQHLB-UHFFFAOYSA-N
SMILES:
OC(=O)CCc1ccc(c2c1cccc2)F
Properties
Complexity:
254  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
218.074g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
218.227g/mol
Monoisotopic Mass:
218.074g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3  
Properties