N-butyl-4-propoxyaniline

N-butyl-4-propoxyaniline

CAS: 1040688-70-7

Formula: C13H21NO

SMILES: CCCCNC1=CC=C(OCCC)C=C1

IUPAC: N-butyl-4-propoxyaniline

InChI: InChI=1S/C13H21NO/c1-3-5-10-14-12-6-8-13(9-7-12)15-11-4-2/h6-9,14H,3-5,10-11H2,1-2H3

Composition: C (75.32%), H (10.21%), N (6.76%), O (7.72%)

Molar Mass: 207.317

Atom Count: 36

Heavy Atom Count: 15

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	207.1623143
Formal Charge	0
FSP3	0.54
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
InChIKey	XKTSXRFPQQEVMN-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	65.86
Topological Polar Surface Area	21.26
Polarizability	25.05
Ring Count	1
Rotatable Bond Count	7

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