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Home > Aldehydes > 192819-68-4
192819-68-4 | Benzaldehyde, 3-(chloromethyl)-2-hydroxy-5-methyl-
CAS No: 192819-68-4 Catalog No: AG002GCT MDL No:MFCD03055723
Product Description
Catalog Number:
AG002GCT
Chemical Name:
Benzaldehyde, 3-(chloromethyl)-2-hydroxy-5-methyl-
CAS Number:
192819-68-4
Molecular Formula:
C9H9ClO2
Molecular Weight:
184.6196
MDL Number:
MFCD03055723
IUPAC Name:
3-(chloromethyl)-2-hydroxy-5-methylbenzaldehyde
InChI:
InChI=1S/C9H9ClO2/c1-6-2-7(4-10)9(12)8(3-6)5-11/h2-3,5,12H,4H2,1H3
InChI Key:
ODGOJSMSPQCKKQ-UHFFFAOYSA-N
SMILES:
ClCc1cc(C)cc(c1O)C=O
Properties
Complexity:
161
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:
2
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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