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Home Other Building Blocks 4-Chloro-2-methylbenzyl alcohol

4-Chloro-2-methylbenzyl alcohol

CAS No.:
129716-11-6
Catalog Number:
AG000TLD
Molecular Formula:
C8H9ClO
Molecular Weight:
156.6095
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$50
- +
5g
98%
In Stock USA
United States
$150
- +
10g
98%
In Stock USA
United States
$240
- +
25g
98%
In Stock USA
United States
$500
- +
Product Description
Catalog Number:
AG000TLD
Chemical Name:
4-Chloro-2-methylbenzyl alcohol
CAS Number:
129716-11-6
Molecular Formula:
C8H9ClO
Molecular Weight:
156.6095
MDL Number:
MFCD06201140
IUPAC Name:
(4-chloro-2-methylphenyl)methanol
InChI:
InChI=1S/C8H9ClO/c1-6-4-8(9)3-2-7(6)5-10/h2-4,10H,5H2,1H3
InChI Key:
AHXBDGJNZJKLNE-UHFFFAOYSA-N
SMILES:
OCc1ccc(cc1C)Cl
Properties
Complexity:
105  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
156.034g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
156.609g/mol
Monoisotopic Mass:
156.034g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6  
Literature
Title Journal
Identification of sulfation sites of metabolites and prediction of the compounds' biological effects. Analytical and bioanalytical chemistry 20061001
Properties