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81322-67-0

81322-67-0 | 3-Chloro-6-hydroxy-2,4-dimethylbenzaldehyde

CAS No: 81322-67-0 Catalog No: AG005LDZ MDL No:MFCD00732125

Product Description

Catalog Number:
AG005LDZ
Chemical Name:
3-Chloro-6-hydroxy-2,4-dimethylbenzaldehyde
CAS Number:
81322-67-0
Molecular Formula:
C9H9ClO2
Molecular Weight:
184.6196
MDL Number:
MFCD00732125
IUPAC Name:
3-chloro-6-hydroxy-2,4-dimethylbenzaldehyde
InChI:
InChI=1S/C9H9ClO2/c1-5-3-8(12)7(4-11)6(2)9(5)10/h3-4,12H,1-2H3
InChI Key:
NXNLQPJNVDGFOE-UHFFFAOYSA-N
SMILES:
O=Cc1c(O)cc(c(c1C)Cl)C

Properties

Complexity:
172  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
184.029g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
184.619g/mol
Monoisotopic Mass:
184.029g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9  

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