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1196048-19-7 | 1H-Indole-7-carboxylic acid, 4-fluoro-, ethyl ester
CAS No: 1196048-19-7 Catalog No: AG000PA1 MDL No:MFCD26143075
Product Description
Catalog Number:
AG000PA1
Chemical Name:
1H-Indole-7-carboxylic acid, 4-fluoro-, ethyl ester
CAS Number:
1196048-19-7
Molecular Formula:
C11H10FNO2
Molecular Weight:
207.2010
MDL Number:
MFCD26143075
IUPAC Name:
ethyl 4-fluoro-1H-indole-7-carboxylate
InChI:
InChI=1S/C11H10FNO2/c1-2-15-11(14)8-3-4-9(12)7-5-6-13-10(7)8/h3-6,13H,2H2,1H3
InChI Key:
IDBKQONTDHZFFN-UHFFFAOYSA-N
SMILES:
CCOC(=O)c1ccc(c2c1[nH]cc2)F
Properties
Complexity:
247
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
207.07g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
207.204g/mol
Monoisotopic Mass:
207.07g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
42.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
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