Home Carboxys 1-[(2-fluorophenyl)methyl]-1H-indole-2-carboxylic acid

1-[(2-fluorophenyl)methyl]-1H-indole-2-carboxylic acid

CAS No.:
943109-61-3
Catalog Number:
AG019UZG
Molecular Formula:
C16H12FNO2
Molecular Weight:
269.2704
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Product Description
Catalog Number:
AG019UZG
Chemical Name:
1-[(2-fluorophenyl)methyl]-1H-indole-2-carboxylic acid
CAS Number:
943109-61-3
Molecular Formula:
C16H12FNO2
Molecular Weight:
269.2704
MDL Number:
MFCD11858049
IUPAC Name:
1-[(2-fluorophenyl)methyl]indole-2-carboxylic acid
InChI:
InChI=1S/C16H12FNO2/c17-13-7-3-1-6-12(13)10-18-14-8-4-2-5-11(14)9-15(18)16(19)20/h1-9H,10H2,(H,19,20)
InChI Key:
XYDOYFJXQVZCRB-UHFFFAOYSA-N
SMILES:
Fc1ccccc1Cn1c(cc2c1cccc2)C(=O)O
Properties
Complexity:
362  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
269.085g/mol
Formal Charge:
0
Heavy Atom Count:
20  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
269.275g/mol
Monoisotopic Mass:
269.085g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
42.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6  
Properties