3,5-dimethyl-N-[(3-propoxyphenyl)methyl]aniline

3,5-dimethyl-N-[(3-propoxyphenyl)methyl]aniline

CAS: 1040687-00-0

Formula: C18H23NO

SMILES: CCCOC1=CC=CC(CNC2=CC(C)=CC(C)=C2)=C1

IUPAC: 3,5-dimethyl-N-[(3-propoxyphenyl)methyl]aniline

InChI: InChI=1S/C18H23NO/c1-4-8-20-18-7-5-6-16(12-18)13-19-17-10-14(2)9-15(3)11-17/h5-7,9-12,19H,4,8,13H2,1-3H3

Composition: C (80.26%), H (8.61%), N (5.20%), O (5.94%)

Molar Mass: 269.388

Atom Count: 43

Heavy Atom Count: 20

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	269.177964365
Formal Charge	0
FSP3	0.33
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
InChIKey	CQNZBBYAZUSSON-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	86.68
Topological Polar Surface Area	21.26
Polarizability	32.68
Ring Count	2
Rotatable Bond Count	6

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