Home Other Building Blocks 3-(2-fluorophenyl)butanoic acid

3-(2-fluorophenyl)butanoic acid

CAS No.:
1042815-30-4
Catalog Number:
AG01A9LV
Molecular Formula:
C10H11FO2
Molecular Weight:
182.1915
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Product Description
Catalog Number:
AG01A9LV
Chemical Name:
3-(2-fluorophenyl)butanoic acid
CAS Number:
1042815-30-4
Molecular Formula:
C10H11FO2
Molecular Weight:
182.1915
MDL Number:
MFCD11172877
IUPAC Name:
3-(2-fluorophenyl)butanoic acid
InChI:
InChI=1S/C10H11FO2/c1-7(6-10(12)13)8-4-2-3-5-9(8)11/h2-5,7H,6H2,1H3,(H,12,13)
InChI Key:
FZHRPUPPBOTOHE-UHFFFAOYSA-N
SMILES:
OC(=O)CC(c1ccccc1F)C
Properties
Complexity:
182  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
182.074g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
182.194g/mol
Monoisotopic Mass:
182.074g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1  
Properties