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107356-10-5 | Benzaldehyde, 3-chloro-4-hydroxy-5-methyl-
CAS No: 107356-10-5 Catalog No: AG007ENA MDL No:
Product Description
Catalog Number:
AG007ENA
Chemical Name:
Benzaldehyde, 3-chloro-4-hydroxy-5-methyl-
CAS Number:
107356-10-5
Molecular Formula:
C8H7ClO2
Molecular Weight:
170.5930
IUPAC Name:
3-chloro-4-hydroxy-5-methylbenzaldehyde
InChI:
InChI=1S/C8H7ClO2/c1-5-2-6(4-10)3-7(9)8(5)11/h2-4,11H,1H3
InChI Key:
UFWGXFOKGNJAOS-UHFFFAOYSA-N
SMILES:
O=Cc1cc(C)c(c(c1)Cl)O
Properties
Complexity:
149
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
170.013g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
170.592g/mol
Monoisotopic Mass:
170.013g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2
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