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2,4,6-trimethylbenzene-1,3,5-tricarbaldehyde

2,4,6-trimethylbenzene-1,3,5-tricarbaldehyde

CAS: 119198-88-8

Formula: C12H12O3

SMILES: CC1=C(C=O)C(C)=C(C=O)C(C)=C1C=O

IUPAC: 2,4,6-trimethylbenzene-1,3,5-tricarbaldehyde

InChI: InChI=1S/C12H12O3/c1-7-10(4-13)8(2)12(6-15)9(3)11(7)5-14/h4-6H,1-3H3

Composition: C (70.58%), H (5.92%), O (23.50%)

Molar Mass: 204.225

Atom Count: 27

Heavy Atom Count: 15

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 204.078644246
Formal Charge 0
FSP3 0.25
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 0
InChIKey IBNLLMKGXOOWHH-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 60.93
Topological Polar Surface Area 51.21
Polarizability 21.32
Ring Count 1
Rotatable Bond Count 3

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