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Home > Fluorides > 1803601-85-5
1803601-85-5 | 1H-Indole, 4,6-difluoro-2,3-dihydro-, hydrochloride (1:1)
CAS No: 1803601-85-5 Catalog No: AG0021Y2 MDL No:MFCD09026843
Product Description
Catalog Number:
AG0021Y2
Chemical Name:
1H-Indole, 4,6-difluoro-2,3-dihydro-, hydrochloride (1:1)
CAS Number:
1803601-85-5
Molecular Formula:
C8H8ClF2N
Molecular Weight:
191.6056
MDL Number:
MFCD09026843
IUPAC Name:
4,6-difluoro-2,3-dihydro-1H-indole;hydrochloride
InChI:
InChI=1S/C8H7F2N.ClH/c9-5-3-7(10)6-1-2-11-8(6)4-5;/h3-4,11H,1-2H2;1H
InChI Key:
NDOHUXUMZLPCPV-UHFFFAOYSA-N
SMILES:
Fc1cc(F)c2c(c1)NCC2.Cl
Properties
Complexity:
151
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
191.031g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
191.606g/mol
Monoisotopic Mass:
191.031g/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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