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1000571-93-6 | 3-Fluoro-6-methoxyphenethyl alcohol
CAS No: 1000571-93-6 Catalog No: AG01FDOI MDL No:
Product Description
Catalog Number:
AG01FDOI
Chemical Name:
3-Fluoro-6-methoxyphenethyl alcohol
CAS Number:
1000571-93-6
Molecular Formula:
C9H11FO2
Molecular Weight:
170.1808
IUPAC Name:
2-(5-fluoro-2-methoxyphenyl)ethanol
InChI:
InChI=1S/C9H11FO2/c1-12-9-3-2-8(10)6-7(9)4-5-11/h2-3,6,11H,4-5H2,1H3
InChI Key:
RZLJHDVEADCDNS-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1CCO)F
Properties
Complexity:
130
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
170.074g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
170.183g/mol
Monoisotopic Mass:
170.074g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
29.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
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