3-[(dimethylamino)methyl]-4-ethoxybenzaldehyde

3-[(dimethylamino)methyl]-4-ethoxybenzaldehyde

CAS: 883549-69-7

Formula: C12H17NO2

SMILES: CCOC1=C(CN(C)C)C=C(C=O)C=C1

IUPAC: 3-[(dimethylamino)methyl]-4-ethoxybenzaldehyde

InChI: InChI=1S/C12H17NO2/c1-4-15-12-6-5-10(9-14)7-11(12)8-13(2)3/h5-7,9H,4,8H2,1-3H3

Composition: C (69.54%), H (8.27%), N (6.76%), O (15.44%)

Molar Mass: 207.273

Atom Count: 32

Heavy Atom Count: 15

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	207.125928791
Formal Charge	0
FSP3	0.42
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
InChIKey	HDDOOOGDGTZSAO-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	62.4
Topological Polar Surface Area	29.54
Polarizability	23.63
Ring Count	1
Rotatable Bond Count	5

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