1-[4-(tert-butoxy)phenyl]methanamine

1-[4-(tert-butoxy)phenyl]methanamine

CAS: 84697-13-2

Formula: C11H17NO

SMILES: CC(C)(C)OC1=CC=C(CN)C=C1

IUPAC: 1-[4-(tert-butoxy)phenyl]methanamine

InChI: InChI=1S/C11H17NO/c1-11(2,3)13-10-6-4-9(8-12)5-7-10/h4-7H,8,12H2,1-3H3

Composition: C (73.70%), H (9.56%), N (7.81%), O (8.92%)

Molar Mass: 179.263

Atom Count: 30

Heavy Atom Count: 13

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	179.131014171
Formal Charge	0
FSP3	0.45
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
InChIKey	HOKKUMFXFSCQHJ-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	54.8
Topological Polar Surface Area	35.25
Polarizability	21.76
Ring Count	1
Rotatable Bond Count	3

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OTAVA LTD.

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MFCD06213869

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Struchem co.,ltd

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95%	<5 Days	84697-13-2		$647.00-$1,570.00$647.00$1,570.00

J&W PHARMLAB LLC

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96%	<2 Days	84697-13-2		$171.35-$5,497.00$171.35$227.70$342.70$457.70$1,828.50$5,497.00