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89735-30-8 | 1,2-Benzenediol, 4-fluoro-5-(hydroxymethyl)-
CAS No: 89735-30-8 Catalog No: AG0041HA MDL No:
Product Description
Catalog Number:
AG0041HA
Chemical Name:
1,2-Benzenediol, 4-fluoro-5-(hydroxymethyl)-
CAS Number:
89735-30-8
Molecular Formula:
C7H7FO3
Molecular Weight:
158.1271
IUPAC Name:
4-fluoro-5-(hydroxymethyl)benzene-1,2-diol
InChI:
InChI=1S/C7H7FO3/c8-5-2-7(11)6(10)1-4(5)3-9/h1-2,9-11H,3H2
InChI Key:
RMVVYWAHGBJBTI-UHFFFAOYSA-N
SMILES:
OCc1cc(O)c(cc1F)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:
158.038g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
158.128g/mol
Monoisotopic Mass:
158.038g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
60.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.4
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