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1123-56-4 | 2,6-Dimethylbenzaldehyde
CAS No: 1123-56-4 Catalog No: AG00331V MDL No:MFCD00128003
Product Description
Catalog Number:
AG00331V
Chemical Name:
2,6-Dimethylbenzaldehyde
CAS Number:
1123-56-4
Molecular Formula:
C9H10O
Molecular Weight:
134.1751
MDL Number:
MFCD00128003
IUPAC Name:
2,6-dimethylbenzaldehyde
InChI:
InChI=1S/C9H10O/c1-7-4-3-5-8(2)9(7)6-10/h3-6H,1-2H3
InChI Key:
QOJQBWSZHCKOLL-UHFFFAOYSA-N
SMILES:
O=Cc1c(C)cccc1C
Properties
Complexity:
110
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
134.073g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
134.178g/mol
Monoisotopic Mass:
134.073g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
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