Home Other Building Blocks (2E)-3-(4-fluoronaphthalen-1-yl)prop-2-enoic acid, E

(2E)-3-(4-fluoronaphthalen-1-yl)prop-2-enoic acid, E

CAS No.:
1453089-75-2
Catalog Number:
AG01C08G
Molecular Formula:
C13H9FO2
Molecular Weight:
216.2078
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Product Description
Catalog Number:
AG01C08G
Chemical Name:
(2E)-3-(4-fluoronaphthalen-1-yl)prop-2-enoic acid, E
CAS Number:
1453089-75-2
Molecular Formula:
C13H9FO2
Molecular Weight:
216.2078
MDL Number:
MFCD19653947
IUPAC Name:
3-(4-fluoronaphthalen-1-yl)prop-2-enoic acid
InChI:
InChI=1S/C13H9FO2/c14-12-7-5-9(6-8-13(15)16)10-3-1-2-4-11(10)12/h1-8H,(H,15,16)
InChI Key:
CFKPJMKVXIDBOL-UHFFFAOYSA-N
SMILES:
OC(=O)/C=C/c1ccc(c2c1cccc2)F
Properties
Complexity:
288  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
216.059g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
216.211g/mol
Monoisotopic Mass:
216.059g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1  
XLogP3:
3.2  
Properties