Home Other Building Blocks methyl 3,5-difluoro-4-(hydroxymethyl)benzoate

methyl 3,5-difluoro-4-(hydroxymethyl)benzoate

CAS No.:
1779838-95-7
Catalog Number:
AG01BJKD
Molecular Formula:
C9H8F2O3
Molecular Weight:
202.1548
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Product Description
Catalog Number:
AG01BJKD
Chemical Name:
methyl 3,5-difluoro-4-(hydroxymethyl)benzoate
CAS Number:
1779838-95-7
Molecular Formula:
C9H8F2O3
Molecular Weight:
202.1548
MDL Number:
MFCD28526371
IUPAC Name:
methyl 3,5-difluoro-4-(hydroxymethyl)benzoate
InChI:
InChI=1S/C9H8F2O3/c1-14-9(13)5-2-7(10)6(4-12)8(11)3-5/h2-3,12H,4H2,1H3
InChI Key:
UDNFJLIHDVRZKC-UHFFFAOYSA-N
SMILES:
COC(=O)c1cc(F)c(c(c1)F)CO
Properties
Complexity:
198  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
202.044g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
202.157g/mol
Monoisotopic Mass:
202.044g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
46.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1  
Properties