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Home > Aldehydes > 1416352-12-9
1416352-12-9 | Benzaldehyde, 4,5-dichloro-2-methyl-
CAS No: 1416352-12-9 Catalog No: AG001GQB MDL No:MFCD22566296
Product Description
Catalog Number:
AG001GQB
Chemical Name:
Benzaldehyde, 4,5-dichloro-2-methyl-
CAS Number:
1416352-12-9
Molecular Formula:
C8H6Cl2O
Molecular Weight:
189.0386
MDL Number:
MFCD22566296
IUPAC Name:
4,5-dichloro-2-methylbenzaldehyde
InChI:
InChI=1S/C8H6Cl2O/c1-5-2-7(9)8(10)3-6(5)4-11/h2-4H,1H3
InChI Key:
KQYSEJGMGNLZKS-UHFFFAOYSA-N
SMILES:
O=Cc1cc(Cl)c(cc1C)Cl
Properties
Complexity:
149
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
187.98g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
189.035g/mol
Monoisotopic Mass:
187.98g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3
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