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Home > Fluorides > 141113-36-2
141113-36-2 | Benzeneethanol, 2,4-difluoro-β-methylene-
CAS No: 141113-36-2 Catalog No: AG001FXZ MDL No:MFCD16251339
Product Description
Catalog Number:
AG001FXZ
Chemical Name:
Benzeneethanol, 2,4-difluoro-β-methylene-
CAS Number:
141113-36-2
Molecular Formula:
C9H8F2O
Molecular Weight:
170.1560
MDL Number:
MFCD16251339
IUPAC Name:
2-(2,4-difluorophenyl)prop-2-en-1-ol
InChI:
InChI=1S/C9H8F2O/c1-6(5-12)8-3-2-7(10)4-9(8)11/h2-4,12H,1,5H2
InChI Key:
JONDTFNGQQZTDO-UHFFFAOYSA-N
SMILES:
OCC(=C)c1ccc(cc1F)F
Properties
Complexity:
170
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
170.054g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
170.159g/mol
Monoisotopic Mass:
170.054g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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