5-chloro-2-(cyclopentylmethoxy)aniline

5-chloro-2-(cyclopentylmethoxy)aniline

CAS: 946727-66-8

Formula: C12H16ClNO

SMILES: NC1=C(OCC2CCCC2)C=CC(Cl)=C1

IUPAC: 5-chloro-2-(cyclopentylmethoxy)aniline

InChI: InChI=1S/C12H16ClNO/c13-10-5-6-12(11(14)7-10)15-8-9-3-1-2-4-9/h5-7,9H,1-4,8,14H2

Composition: C (63.86%), H (7.15%), Cl (15.71%), N (6.21%), O (7.09%)

Molar Mass: 225.72

Atom Count: 31

Heavy Atom Count: 15

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	225.0920418
Formal Charge	0
FSP3	0.5
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
InChIKey	CLHIMWJTDHGGSE-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	63.17
Topological Polar Surface Area	35.25
Polarizability	24.32
Ring Count	2
Rotatable Bond Count	3

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