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1378827-60-1 | 4-Fluoro-3-n-propoxyphenethyl alcohol
CAS No: 1378827-60-1 Catalog No: AG01FD2X MDL No:
Product Description
Catalog Number:
AG01FD2X
Chemical Name:
4-Fluoro-3-n-propoxyphenethyl alcohol
CAS Number:
1378827-60-1
Molecular Formula:
C11H15FO2
Molecular Weight:
198.2340
IUPAC Name:
2-(4-fluoro-3-propoxyphenyl)ethanol
InChI:
InChI=1S/C11H15FO2/c1-2-7-14-11-8-9(5-6-13)3-4-10(11)12/h3-4,8,13H,2,5-7H2,1H3
InChI Key:
CXQJMRKOHUMDOK-UHFFFAOYSA-N
SMILES:
CCCOc1cc(CCO)ccc1F
Properties
Complexity:
152
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
198.106g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
198.237g/mol
Monoisotopic Mass:
198.106g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
29.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
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