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1313712-24-1 | 1H-Indole-1-acetic acid, 7-fluoro-
CAS No: 1313712-24-1 Catalog No: AG000W0B MDL No:
Product Description
Catalog Number:
AG000W0B
Chemical Name:
1H-Indole-1-acetic acid, 7-fluoro-
CAS Number:
1313712-24-1
Molecular Formula:
C10H8FNO2
Molecular Weight:
193.1744
IUPAC Name:
2-(7-fluoroindol-1-yl)acetic acid
InChI:
InChI=1S/C10H8FNO2/c11-8-3-1-2-7-4-5-12(10(7)8)6-9(13)14/h1-5H,6H2,(H,13,14)
InChI Key:
XWRFQLMCZGCXQB-UHFFFAOYSA-N
SMILES:
OC(=O)Cn1ccc2c1c(F)ccc2
Properties
Complexity:
234
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
193.054g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
193.177g/mol
Monoisotopic Mass:
193.054g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
42.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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