Home Other Building Blocks METHYL 2-(3,4-DIFLUOROPHENYL)-2-HYDROXYACETATE

METHYL 2-(3,4-DIFLUOROPHENYL)-2-HYDROXYACETATE

CAS No.:
1001159-02-9
Catalog Number:
AG01DUVY
Molecular Formula:
C9H8F2O3
Molecular Weight:
202.1548
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Product Description
Catalog Number:
AG01DUVY
Chemical Name:
METHYL 2-(3,4-DIFLUOROPHENYL)-2-HYDROXYACETATE
CAS Number:
1001159-02-9
Molecular Formula:
C9H8F2O3
Molecular Weight:
202.1548
MDL Number:
MFCD16693815
IUPAC Name:
methyl 2-(3,4-difluorophenyl)-2-hydroxyacetate
InChI:
InChI=1S/C9H8F2O3/c1-14-9(13)8(12)5-2-3-6(10)7(11)4-5/h2-4,8,12H,1H3
InChI Key:
FSNBVAIULMGGMB-UHFFFAOYSA-N
SMILES:
COC(=O)C(c1ccc(c(c1)F)F)O
Properties
Complexity:
210  
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:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4  
Properties