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Home > Fluorides > 229028-02-8
229028-02-8 | Benzenemethanol, 2-ethynyl-4-fluoro-
CAS No: 229028-02-8 Catalog No: AG002LET MDL No:MFCD18825446
Product Description
Catalog Number:
AG002LET
Chemical Name:
Benzenemethanol, 2-ethynyl-4-fluoro-
CAS Number:
229028-02-8
Molecular Formula:
C9H7FO
Molecular Weight:
150.1497
MDL Number:
MFCD18825446
IUPAC Name:
(2-ethynyl-4-fluorophenyl)methanol
InChI:
InChI=1S/C9H7FO/c1-2-7-5-9(10)4-3-8(7)6-11/h1,3-5,11H,6H2
InChI Key:
AUNFAUCCAPEMQU-UHFFFAOYSA-N
SMILES:
C#Cc1cc(F)ccc1CO
Properties
Complexity:
170
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
150.048g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
150.152g/mol
Monoisotopic Mass:
150.048g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4
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