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88174-45-2 | Benzaldehyde, 3,5-dichloro-2,4,6-trimethyl-
CAS No: 88174-45-2 Catalog No: AG008BPJ MDL No:
Product Description
Catalog Number:
AG008BPJ
Chemical Name:
Benzaldehyde, 3,5-dichloro-2,4,6-trimethyl-
CAS Number:
88174-45-2
Molecular Formula:
C10H10Cl2O
Molecular Weight:
217.0918
IUPAC Name:
3,5-dichloro-2,4,6-trimethylbenzaldehyde
InChI:
InChI=1S/C10H10Cl2O/c1-5-8(4-13)6(2)10(12)7(3)9(5)11/h4H,1-3H3
InChI Key:
LUFXGTIXKIHBBV-UHFFFAOYSA-N
SMILES:
O=Cc1c(C)c(Cl)c(c(c1C)Cl)C
Properties
Complexity:
179
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
216.011g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
217.089g/mol
Monoisotopic Mass:
216.011g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7
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