Home Other Building Blocks 2,2-difluoro-2-(4-hydroxyoxan-4-yl)acetic acid

2,2-difluoro-2-(4-hydroxyoxan-4-yl)acetic acid

CAS No.:
681240-12-0
Catalog Number:
AG01EK8T
Molecular Formula:
C7H10F2O4
Molecular Weight:
196.1487
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Product Description
Catalog Number:
AG01EK8T
Chemical Name:
2,2-difluoro-2-(4-hydroxyoxan-4-yl)acetic acid
CAS Number:
681240-12-0
Molecular Formula:
C7H10F2O4
Molecular Weight:
196.1487
MDL Number:
MFCD16749769
IUPAC Name:
2,2-difluoro-2-(4-hydroxyoxan-4-yl)acetic acid
InChI:
InChI=1S/C7H10F2O4/c8-7(9,5(10)11)6(12)1-3-13-4-2-6/h12H,1-4H2,(H,10,11)
InChI Key:
BQVRHLNGMNBUGZ-UHFFFAOYSA-N
SMILES:
OC(=O)C(C1(O)CCOCC1)(F)F
Properties
Complexity:
211  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
196.055g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
196.15g/mol
Monoisotopic Mass:
196.055g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
66.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6  
Properties