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1555541-10-0 | 1-(3-Fluoro-6-methoxyphenyl)-1-cyclopropyl ethanol
CAS No: 1555541-10-0 Catalog No: AG01EU97 MDL No:
Product Description
Catalog Number:
AG01EU97
Chemical Name:
1-(3-Fluoro-6-methoxyphenyl)-1-cyclopropyl ethanol
CAS Number:
1555541-10-0
Molecular Formula:
C12H15FO2
Molecular Weight:
210.2447
IUPAC Name:
1-cyclopropyl-1-(5-fluoro-2-methoxyphenyl)ethanol
InChI:
InChI=1S/C12H15FO2/c1-12(14,8-3-4-8)10-7-9(13)5-6-11(10)15-2/h5-8,14H,3-4H2,1-2H3
InChI Key:
HTIBOEDSJRFFJL-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1C(C1CC1)(O)C)F
Properties
Complexity:
230
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
210.106g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
210.248g/mol
Monoisotopic Mass:
210.106g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
29.5A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
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