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IN-F 7321

CAT: 0926-GGA16213-01Size: 250 mgDry Ice: NoHazardous: No
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CAT#:0926-GGA16213-01Size:250 mg
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CAS Number
156162-13-9
Smiles
C[Si] (C1=CC=C (C=C1) F) (C2=CC=C (C=C2) F) O
Molecular Formula
C13H12F2OSi
Molecular Weight
250.31 g/mol
Controlled
No

Chemical Information

1,1-Bis(4-fluorophenyl)-1-methylsilanol
CAS Number156162-13-9
PubChem CID15390574
IUPAC Namebis(4-fluorophenyl)-hydroxy-methylsilane
Molecular FormulaC13H12F2OSi
Molecular Weight250.31
Topological Polar Surface Area20.2
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count2
Heavy Atom Count17
Formal Charge0
Complexity224
SMILES
C[Si](C1=CC=C(C=C1)F)(C2=CC=C(C=C2)F)O
InChI
InChI=1S/C13H12F2OSi/c1-17(16,12-6-2-10(14)3-7-12)13-8-4-11(15)5-9-13/h2-9,16H,1H3
InChIKey
HVYDPFLJJBFJJD-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 1,1-Bis(4-fluorophenyl)-1-methylsilanol
CAS: 156162-13-9
CID: 15390574
Formula: C13H12F2OSi
MW: 250.31
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight250.31
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count2
Exact Mass250.06254786
Monoisotopic Mass250.06254786
Topological Polar Surface Area20.2 Ų
Heavy Atom Count17
Formal Charge0
Complexity224
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes