3-chloro-4-methoxy-N-[(5-methylthiophen-2-yl)methyl]aniline

3-chloro-4-methoxy-N-[(5-methylthiophen-2-yl)methyl]aniline

Formula: C13H14ClNOS

SMILES: COC1=CC=C(NCC2=CC=C(C)S2)C=C1Cl

IUPAC: 3-chloro-4-methoxy-N-[(5-methylthiophen-2-yl)methyl]aniline

InChI: InChI=1S/C13H14ClNOS/c1-9-3-5-11(17-9)8-15-10-4-6-13(16-2)12(14)7-10/h3-7,15H,8H2,1-2H3

Composition: C (58.31%), H (5.27%), Cl (13.24%), N (5.23%), O (5.97%), S (11.97%)

Molar Mass: 267.77

Atom Count: 31

Heavy Atom Count: 17

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	267.0484629
Formal Charge	0
FSP3	0.23
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
InChIKey	PFDUTXJQEBGHGL-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	74.08
Topological Polar Surface Area	21.26
Polarizability	27.72
Ring Count	2
Rotatable Bond Count	4

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C13H14ClNOS		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00