Home Other Building Blocks methyl 6-fluoro-2-formyl-3-hydroxybenzoate

methyl 6-fluoro-2-formyl-3-hydroxybenzoate

CAS No.:
1427373-40-7
Catalog Number:
AG01DW1A
Molecular Formula:
C9H7FO4
Molecular Weight:
198.1479
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Product Description
Catalog Number:
AG01DW1A
Chemical Name:
methyl 6-fluoro-2-formyl-3-hydroxybenzoate
CAS Number:
1427373-40-7
Molecular Formula:
C9H7FO4
Molecular Weight:
198.1479
MDL Number:
MFCD23705551
IUPAC Name:
methyl 6-fluoro-2-formyl-3-hydroxybenzoate
InChI:
InChI=1S/C9H7FO4/c1-14-9(13)8-5(4-11)7(12)3-2-6(8)10/h2-4,12H,1H3
InChI Key:
XXUPGJLOGOKKGB-UHFFFAOYSA-N
SMILES:
COC(=O)c1c(F)ccc(c1C=O)O
Properties
Complexity:
231  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
198.033g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
198.149g/mol
Monoisotopic Mass:
198.033g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
63.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5  
Properties