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Home Other Building Blocks 2-Chloro-4-methylphenol

2-Chloro-4-methylphenol

CAS No.:
6640-27-3
Catalog Number:
AG003381
Molecular Formula:
C7H7ClO
Molecular Weight:
142.5829
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$35
- +
5g
95%
In Stock USA
United States
$55
- +
10g
95%
In Stock USA
United States
$76
- +
25g
95%
In Stock USA
United States
$125
- +
Product Description
Catalog Number:
AG003381
Chemical Name:
2-Chloro-4-methylphenol
CAS Number:
6640-27-3
Molecular Formula:
C7H7ClO
Molecular Weight:
142.5829
MDL Number:
MFCD00070639
IUPAC Name:
2-chloro-4-methylphenol
InChI:
InChI=1S/C7H7ClO/c1-5-2-3-7(9)6(8)4-5/h2-4,9H,1H3
InChI Key:
AQJFATAFTQCRGC-UHFFFAOYSA-N
SMILES:
Cc1ccc(c(c1)Cl)O
EC Number:
229-656-8
UNII:
1J012K1LJC
NSC Number:
48848
Properties
Complexity:
94.9  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
142.019g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
142.582g/mol
Monoisotopic Mass:
142.019g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4  
Literature
Title Journal
N-Benzyl-2-(2-chloro-4-methyl-phen-oxy)acetamide. Acta crystallographica. Section E, Structure reports online 20080801
Prediction of estrogen receptor agonists and characterization of associated molecular descriptors by statistical learning methods. Journal of molecular graphics & modelling 20061101
Metabolism of 2-chloro-4-methylphenoxyacetate by Alcaligenes eutrophus JMP 134. Archives of microbiology 19930101
Properties