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1- (4-fluorophenyl) -2-methylpropan-1-ol

CAT: 0127-PC1023975-01Size: 250 mgDry Ice: NoHazardous: No
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CAT#:0127-PC1023975-01Size:250 mg
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CAS Number
1766-28-5
MDL Number
MFCD11934573
Purity
97%
Smiles
C1c (ccc (c1) C (C (C) C) O) F

Chemical Information

1-(4-Fluorophenyl)-2-methylpropan-1-ol
CAS Number1766-28-5
PubChem CID10419564
IUPAC Name1-(4-fluorophenyl)-2-methylpropan-1-ol
Molecular FormulaC10H13FO
Molecular Weight168.21
XLogP2.5
Topological Polar Surface Area20.2
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count2
Heavy Atom Count12
Formal Charge0
Complexity128
SMILES
CC(C)C(C1=CC=C(C=C1)F)O
InChI
InChI=1S/C10H13FO/c1-7(2)10(12)8-3-5-9(11)6-4-8/h3-7,10,12H,1-2H3
InChIKey
NVTZVRJGHWXKET-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 1-(4-Fluorophenyl)-2-methylpropan-1-ol
CAS: 1766-28-5
CID: 10419564
Formula: C10H13FO
MW: 168.21
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight168.21
XLogP32.5
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count2
Exact Mass168.095043196
Monoisotopic Mass168.095043196
Topological Polar Surface Area20.2 Ų
Heavy Atom Count12
Formal Charge0
Complexity128
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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Alternative Products

CatalogName
LXB58431-013- (4-Fluorophenyl) -2-methylpropan-1-ol
BAA960551- (2-Fluorophenyl) -2-methylpropan-2-ol
408128-011- (4-Fluorophenyl) -2-methylpropan-1-one
sc-3328901- (4-fluorophenyl) -2-methylpropan-1-amine
HY-W330702-011- (4-Fluorophenyl) -2-methylpropan-2-amine
HBA45437-012- (4-Bromophenyl) -2-methylpropan-1-ol
KAA40018-011- (4-Chlorophenyl) -2-methylpropan-1-ol
HCA46991-011- (4-Bromophenyl) -2-methylpropan-2-ol
413586-012- (4-Aminophenyl) -2-methylpropan-1-ol
ZTB66523-011- (4-Aminophenoxy) -2-methylpropan-2-ol

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