Home Halogens 5-chloro-4-hydroxy-2-methylbenzonitrile

5-chloro-4-hydroxy-2-methylbenzonitrile

CAS No.:
1891175-05-5
Catalog Number:
AG01DZ6X
Molecular Formula:
C8H6ClNO
Molecular Weight:
167.5923
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Product Description
Catalog Number:
AG01DZ6X
Chemical Name:
5-chloro-4-hydroxy-2-methylbenzonitrile
CAS Number:
1891175-05-5
Molecular Formula:
C8H6ClNO
Molecular Weight:
167.5923
IUPAC Name:
5-chloro-4-hydroxy-2-methylbenzonitrile
InChI:
InChI=1S/C8H6ClNO/c1-5-2-8(11)7(9)3-6(5)4-10/h2-3,11H,1H3
InChI Key:
AEYLQGYNRNPYKZ-UHFFFAOYSA-N
SMILES:
N#Cc1cc(Cl)c(cc1C)O
Properties
Complexity:
186  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
167.014g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
167.592g/mol
Monoisotopic Mass:
167.014g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
44A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3  
Properties