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1314903-97-3 | 4-Chloro-3,5-dimethylphenethyl alcohol
CAS No: 1314903-97-3 Catalog No: AG01FCMD MDL No:
Product Description
Catalog Number:
AG01FCMD
Chemical Name:
4-Chloro-3,5-dimethylphenethyl alcohol
CAS Number:
1314903-97-3
Molecular Formula:
C10H13ClO
Molecular Weight:
184.6626
IUPAC Name:
2-(4-chloro-3,5-dimethylphenyl)ethanol
InChI:
InChI=1S/C10H13ClO/c1-7-5-9(3-4-12)6-8(2)10(7)11/h5-6,12H,3-4H2,1-2H3
InChI Key:
WGYWVFCQUZZHJB-UHFFFAOYSA-N
SMILES:
OCCc1cc(C)c(c(c1)C)Cl
Properties
Complexity:
126
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
184.065g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
184.663g/mol
Monoisotopic Mass:
184.065g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9
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