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Home > Fluorides > 1447606-44-1
1447606-44-1 | 1H-Isoindole, 4-fluoro-2,3-dihydro-5-methoxy-, hydrochloride (1:1)
CAS No: 1447606-44-1 Catalog No: AG001K45 MDL No:MFCD25542148
Product Description
Catalog Number:
AG001K45
Chemical Name:
1H-Isoindole, 4-fluoro-2,3-dihydro-5-methoxy-, hydrochloride (1:1)
CAS Number:
1447606-44-1
Molecular Formula:
C9H11ClFNO
Molecular Weight:
203.6411
MDL Number:
MFCD25542148
IUPAC Name:
4-fluoro-5-methoxy-2,3-dihydro-1H-isoindole;hydrochloride
InChI:
InChI=1S/C9H10FNO.ClH/c1-12-8-3-2-6-4-11-5-7(6)9(8)10;/h2-3,11H,4-5H2,1H3;1H
InChI Key:
CXUGKPAUJJAQEC-UHFFFAOYSA-N
SMILES:
COc1ccc2c(c1F)CNC2.Cl
Properties
Complexity:
165
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
203.051g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
203.641g/mol
Monoisotopic Mass:
203.051g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
21.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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