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103439-04-9 | Benzenemethanol,2-fluoro-3-hydroxy-a-[(methylamino)methyl]-
CAS No: 103439-04-9 Catalog No: AG007GOV MDL No:
Product Description
Catalog Number:
AG007GOV
Chemical Name:
Benzenemethanol,2-fluoro-3-hydroxy-a-[(methylamino)methyl]-
CAS Number:
103439-04-9
Molecular Formula:
C9H12FNO2
Molecular Weight:
185.1955
IUPAC Name:
2-fluoro-3-[1-hydroxy-2-(methylamino)ethyl]phenol
InChI:
InChI=1S/C9H12FNO2/c1-11-5-8(13)6-3-2-4-7(12)9(6)10/h2-4,8,11-13H,5H2,1H3
InChI Key:
KFHINOFEYCZOKN-UHFFFAOYSA-N
SMILES:
CNCC(c1cccc(c1F)O)O
Properties
Complexity:
157
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
185.085g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
185.198g/mol
Monoisotopic Mass:
185.085g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
52.5A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
0.4
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