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Home > Fluorides > 1013398-57-6
1013398-57-6 | 1H-Indole, 5-fluoro-2,3-dihydro-, hydrochloride (1:1)
CAS No: 1013398-57-6 Catalog No: AG000490 MDL No:MFCD12761537
Product Description
Catalog Number:
AG000490
Chemical Name:
1H-Indole, 5-fluoro-2,3-dihydro-, hydrochloride (1:1)
CAS Number:
1013398-57-6
Molecular Formula:
C8H9ClFN
Molecular Weight:
173.6152
MDL Number:
MFCD12761537
IUPAC Name:
5-fluoro-2,3-dihydro-1H-indole;hydrochloride
InChI:
InChI=1S/C8H8FN.ClH/c9-7-1-2-8-6(5-7)3-4-10-8;/h1-2,5,10H,3-4H2;1H
InChI Key:
YEJGKJFDBXHDPX-UHFFFAOYSA-N
SMILES:
Fc1ccc2c(c1)CCN2.Cl
Properties
Complexity:
126
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
173.041g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
173.615g/mol
Monoisotopic Mass:
173.041g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
12A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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