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Home > Fluorides > 951888-11-2
951888-11-2 | 3-(3-Fluoro-4-methoxyphenyl)-2-methyl-1-propene
CAS No: 951888-11-2 Catalog No: AG01EZRL MDL No:
Product Description
Catalog Number:
AG01EZRL
Chemical Name:
3-(3-Fluoro-4-methoxyphenyl)-2-methyl-1-propene
CAS Number:
951888-11-2
Molecular Formula:
C11H13FO
Molecular Weight:
180.2187
IUPAC Name:
2-fluoro-1-methoxy-4-(2-methylprop-2-enyl)benzene
InChI:
InChI=1S/C11H13FO/c1-8(2)6-9-4-5-11(13-3)10(12)7-9/h4-5,7H,1,6H2,2-3H3
InChI Key:
CVPCPTQBSKTJBL-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1F)CC(=C)C
Properties
Complexity:
179
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
180.095g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
180.222g/mol
Monoisotopic Mass:
180.095g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7
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