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

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

CAS: 628311-20-6

Formula: C11H15NO2

SMILES: COC1=C(CN(C)C)C=C(C=O)C=C1

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

InChI: InChI=1S/C11H15NO2/c1-12(2)7-10-6-9(8-13)4-5-11(10)14-3/h4-6,8H,7H2,1-3H3

Composition: C (68.37%), H (7.82%), N (7.25%), O (16.56%)

Molar Mass: 193.246

Atom Count: 29

Heavy Atom Count: 14

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	193.110278727
Formal Charge	0
FSP3	0.36
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
InChIKey	XFKLXGABLWFCLC-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	57.65
Topological Polar Surface Area	29.54
Polarizability	21.78
Ring Count	1
Rotatable Bond Count	4

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