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(R) -1- (4-Chlorophenyl) ethanol

CAT: 0127-OR949510-01Size: 250 mgDry Ice: NoHazardous: No
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CAT#:0127-OR949510-01Size:250 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
75968-40-0
MDL Number
MFCD06797295
Purity
97%
Smiles
C[C@@H](O)c1ccc(Cl)cc1

Chemical Information

(1R)-1-(4-chlorophenyl)ethan-1-ol
CAS Number75968-40-0
PubChem CID643324
IUPAC Name(1R)-1-(4-chlorophenyl)ethanol
Molecular FormulaC8H9ClO
Molecular Weight156.61
XLogP2.1
Topological Polar Surface Area20.2
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count1
Rotatable Bond Count1
Heavy Atom Count10
Formal Charge0
Complexity97
SMILES
C[C@H](C1=CC=C(C=C1)Cl)O
InChI
InChI=1S/C8H9ClO/c1-6(10)7-2-4-8(9)5-3-7/h2-6,10H,1H3/t6-/m1/s1
InChIKey
MVOSNPUNXINWAD-ZCFIWIBFSA-N
Chemical Structure
2D Structure
2D structure of (1R)-1-(4-chlorophenyl)ethan-1-ol
CAS: 75968-40-0
CID: 643324
Formula: C8H9ClO
MW: 156.61
Interactive 3D Structure
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Computed Properties
PropertyValue
Molecular Weight156.61
XLogP32.1
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count1
Rotatable Bond Count1
Exact Mass156.0341926
Monoisotopic Mass156.0341926
Topological Polar Surface Area20.2 Ų
Heavy Atom Count10
Formal Charge0
Complexity97.4
Isotope Atom Count0
Defined Atom Stereocenter Count1
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes