3-[(4-methylphenyl)amino]-2-(thiophen-3-yl)prop-2-enenitrile

3-[(4-methylphenyl)amino]-2-(thiophen-3-yl)prop-2-enenitrile

CAS: 1164478-97-0

Formula: C14H12N2S

SMILES: CC1=CC=C(NC=C(C#N)C2=CSC=C2)C=C1

IUPAC: 3-[(4-methylphenyl)amino]-2-(thiophen-3-yl)prop-2-enenitrile

InChI: InChI=1S/C14H12N2S/c1-11-2-4-14(5-3-11)16-9-13(8-15)12-6-7-17-10-12/h2-7,9-10,16H,1H3

Composition: C (69.97%), H (5.03%), N (11.66%), S (13.34%)

Molar Mass: 240.32

Atom Count: 29

Heavy Atom Count: 17

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	240.072119568
Formal Charge	0
FSP3	0.07
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
InChIKey	MUMLJJBCDLNKTP-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	72.84
Topological Polar Surface Area	35.82
Polarizability	26.59
Ring Count	2
Rotatable Bond Count	3

Suppliers

Key Organics Ltd

Supplier Profile

Purity	LeadTime	CAS	PacketSize	UnitPrice
90%	<2 Days	1164478-97-0		$51.35-$524.40$51.35$63.37$86.31$524.40