Home Halogens 2-chloro-4-methoxy-6-methylphenol

2-chloro-4-methoxy-6-methylphenol

CAS No.:
1824155-21-6
Catalog Number:
AG01C537
Molecular Formula:
C8H9ClO2
Molecular Weight:
172.6089
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Product Description
Catalog Number:
AG01C537
Chemical Name:
2-chloro-4-methoxy-6-methylphenol
CAS Number:
1824155-21-6
Molecular Formula:
C8H9ClO2
Molecular Weight:
172.6089
MDL Number:
MFCD22415112
IUPAC Name:
2-chloro-4-methoxy-6-methylphenol
InChI:
InChI=1S/C8H9ClO2/c1-5-3-6(11-2)4-7(9)8(5)10/h3-4,10H,1-2H3
InChI Key:
XHHDKHCGMWEGGY-UHFFFAOYSA-N
SMILES:
COc1cc(C)c(c(c1)Cl)O
Properties
Complexity:
129  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
172.029g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
172.608g/mol
Monoisotopic Mass:
172.029g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
29.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5  
Properties