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1-Phenylethanol

CAT: 1299-RG-P080516-02Size: 25 mgDry Ice: NoHazardous: No
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CAT#:1299-RG-P080516-02Size:25 mg
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CAS Number
98-85-1
Synonyms
1-phenylethanol
Molecular Formula
C8H10O
Molecular Weight
122.16
Target Alternative Name
Fluoxetine
Product Name Synonym
1-phenylethanol

Chemical Information

1-Phenylethanol

1-phenylethanol is an aromatic alcohol that is ethanol substituted by a phenyl group at position 1. It has a role as a mouse metabolite.

CAS Number98-85-1
PubChem CID7409
IUPAC Name1-phenylethanol
Molecular FormulaC8H10O
Molecular Weight122.16
XLogP1.4
Topological Polar Surface Area20.2
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count1
Rotatable Bond Count1
Heavy Atom Count9
Formal Charge0
Complexity74
SMILES
CC(C1=CC=CC=C1)O
InChI
InChI=1S/C8H10O/c1-7(9)8-5-3-2-4-6-8/h2-7,9H,1H3
InChIKey
WAPNOHKVXSQRPX-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 1-Phenylethanol
CAS: 98-85-1
CID: 7409
Formula: C8H10O
MW: 122.16
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight122.16
XLogP31.4
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count1
Rotatable Bond Count1
Exact Mass122.073164938
Monoisotopic Mass122.073164938
Topological Polar Surface Area20.2 Ų
Heavy Atom Count9
Formal Charge0
Complexity74.6
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

Related Products

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RG-E141397-011,2-Dichloro-1-phenylethane
RG-C081806-012-Chloro-1-Phenylethanone
RG-H251832-012-Hydroxy-1-Phenylethanone
RG-E140245-01(S) -1-phenylethane-1-sulfonic acid
RG-E140244-01(R) -1-phenylethane-1-sulfonic acid
RG-P022642-012-Amino-1-Phenylethan-1-Ol
RG-E242686-011-hydroxy-2-phenylethane-1-sulfonic acid

Alternative Products

CatalogName
OR1004253-011-Phenylethanol
MBS3609552-01(S)-(-)-1-Phenylethanol
M19564-01(S) - (-) -1-Phenylethanol
287324-01S-1-PHENYLETHANOL
sc-2558671-Phenylethanol-D10
27114-32DL-1-Phenylethanol
287323-01(R) -1-PHENYLETHANOL
M226196(±)-1-Phenylethanol-d10
sc-250864A(R) - (+) -1-Phenylethanol
OR1054194-011-Cyclopropyl-1-phenylethanol

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