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1236363-12-4 | Benzenemethanol, 2-chloro-3-fluoro-α-methyl-
CAS No: 1236363-12-4 Catalog No: AG000KWM MDL No:
Product Description
Catalog Number:
AG000KWM
Chemical Name:
Benzenemethanol, 2-chloro-3-fluoro-α-methyl-
CAS Number:
1236363-12-4
Molecular Formula:
C8H8ClFO
Molecular Weight:
174.5999
IUPAC Name:
1-(2-chloro-3-fluorophenyl)ethanol
InChI:
InChI=1S/C8H8ClFO/c1-5(11)6-3-2-4-7(10)8(6)9/h2-5,11H,1H3
InChI Key:
KPGKCJKTJSUUJP-UHFFFAOYSA-N
SMILES:
CC(c1cccc(c1Cl)F)O
Properties
Complexity:
131
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
174.025g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
174.599g/mol
Monoisotopic Mass:
174.025g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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