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70163-98-3 | Methyl 3-fluoro-2-hydroxybenzoate
CAS No: 70163-98-3 Catalog No: AG005KS1 MDL No:MFCD06203651
Product Description
Catalog Number:
AG005KS1
Chemical Name:
Methyl 3-fluoro-2-hydroxybenzoate
CAS Number:
70163-98-3
Molecular Formula:
C8H7FO3
Molecular Weight:
170.1378
MDL Number:
MFCD06203651
IUPAC Name:
methyl 3-fluoro-2-hydroxybenzoate
InChI:
InChI=1S/C8H7FO3/c1-12-8(11)5-3-2-4-6(9)7(5)10/h2-4,10H,1H3
InChI Key:
NRGQRZHYRCJTKV-UHFFFAOYSA-N
SMILES:
COC(=O)c1cccc(c1O)F
Properties
Complexity:
172
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
170.038g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
170.139g/mol
Monoisotopic Mass:
170.038g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
46.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
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