Home Other Building Blocks 2,2-difluoro-2-(1-hydroxycycloheptyl)acetic acid

2,2-difluoro-2-(1-hydroxycycloheptyl)acetic acid

CAS No.:
681240-11-9
Catalog Number:
AG01EK8K
Molecular Formula:
C9H14F2O3
Molecular Weight:
208.2025
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Product Description
Catalog Number:
AG01EK8K
Chemical Name:
2,2-difluoro-2-(1-hydroxycycloheptyl)acetic acid
CAS Number:
681240-11-9
Molecular Formula:
C9H14F2O3
Molecular Weight:
208.2025
MDL Number:
MFCD16749723
IUPAC Name:
2,2-difluoro-2-(1-hydroxycycloheptyl)acetic acid
InChI:
InChI=1S/C9H14F2O3/c10-9(11,7(12)13)8(14)5-3-1-2-4-6-8/h14H,1-6H2,(H,12,13)
InChI Key:
STESVQMGDQVKGD-UHFFFAOYSA-N
SMILES:
OC(=O)C(C1(O)CCCCCC1)(F)F
Properties
Complexity:
220  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
208.091g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
208.205g/mol
Monoisotopic Mass:
208.091g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
57.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5  
Properties