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Home > Aldehydes > 886504-65-0
886504-65-0 | 5-Chloromethyl-2-hydroxy-3-methyl-benzaldehyde
CAS No: 886504-65-0 Catalog No: AG01EYFY MDL No:
Product Description
Catalog Number:
AG01EYFY
Chemical Name:
5-Chloromethyl-2-hydroxy-3-methyl-benzaldehyde
CAS Number:
886504-65-0
Molecular Formula:
C9H9ClO2
Molecular Weight:
184.6196
IUPAC Name:
5-(chloromethyl)-2-hydroxy-3-methylbenzaldehyde
InChI:
InChI=1S/C9H9ClO2/c1-6-2-7(4-10)3-8(5-11)9(6)12/h2-3,5,12H,4H2,1H3
InChI Key:
RPISHNNNYURMND-UHFFFAOYSA-N
SMILES:
ClCc1cc(C=O)c(c(c1)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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