Home Other Building Blocks 4,4,4-trifluoro-2,3-dihydroxy-3-phenylbutanoic acid

4,4,4-trifluoro-2,3-dihydroxy-3-phenylbutanoic acid

CAS No.:
1989671-67-1
Catalog Number:
AG01B5IV
Molecular Formula:
C10H9F3O4
Molecular Weight:
250.1713
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Product Description
Catalog Number:
AG01B5IV
Chemical Name:
4,4,4-trifluoro-2,3-dihydroxy-3-phenylbutanoic acid
CAS Number:
1989671-67-1
Molecular Formula:
C10H9F3O4
Molecular Weight:
250.1713
MDL Number:
MFCD30342770
IUPAC Name:
4,4,4-trifluoro-2,3-dihydroxy-3-phenylbutanoic acid
InChI:
InChI=1S/C10H9F3O4/c11-10(12,13)9(17,7(14)8(15)16)6-4-2-1-3-5-6/h1-5,7,14,17H,(H,15,16)
InChI Key:
MFOJSXRKNQFBTO-UHFFFAOYSA-N
SMILES:
OC(C(C(F)(F)F)(c1ccccc1)O)C(=O)O
Properties
Complexity:
286  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
250.045g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
7  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
250.173g/mol
Monoisotopic Mass:
250.045g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
77.8A^2
Undefined Atom Stereocenter Count:
2  
Undefined Bond Stereocenter Count:
0
XLogP3:
1  
Properties