(E)-2-(2-chlorophenyl)-3-(2-nitrophenyl)prop-2-enoic acid

Formula:C15H10NO4Cl Mutagenic:none Tumorigenic:none Reproductive Effective:high (E)-2-(2-chlorophenyl)-3-(2-nitrophenyl)prop-2-enoic acid is a drug-like molecule.

MolName	(E)-2-(2-chlorophenyl)-3-(2-nitrophenyl)prop-2-enoic acid
MolecularFormula	C15H10NO4Cl
Smiles	[O-][N+](c1c(/C=C(/C(O)=O)\c(cccc2)c2Cl)cccc1)=O
InChI	InChI=1S/C15H10ClNO4/c16-13-7-3-2-6-11(13)12(15(18)19)9-10-5-1-4-8-14(10)17(20)21/h1-9H,(H,18,19)
InChIK	CKSJGADGMCUPQT-UHFFFAOYSA-N
TotalMolweight	303.7
Molweight	303.7
MonoisotopicMass	303.029836
CLogP	2.4951
CLogS	-4.152
H Acceptors	5
H Donors	1
TotalSurfaceArea	220.92
Relative PSA	0.25602
PolarSurfaceArea	83.12
Druglikeness	-4.6722
Mutagenic	none
Tumorigenic	none
Reproductive Effective	high
Irritant	none
Nasty Functions	aromatic nitro
Shape Index	0.47619
Fragments	1
Non HAtoms	21
NonCHAtoms	6
Electronegative Atoms	6
Rotatable Bond	4
Rings Closures	2
Small Rings	2
Aromatic Rings	2
Aromatic Atoms	12
Sp3Atoms	2
AcidicOxygens	2
StereoCon

Click to Load Molecule:

1 - (E)-2-(2-chlorophenyl)-3-(2-nitrophenyl)prop-2-enoic acid | 2 - (E)-2-(2-chlorophenyl)-3-(2-nitrophenyl)prop-2-enoic acid

Request More Details | (E)-2-(2-chlorophenyl)-3-(2-nitrophenyl)prop-2-enoic acid

SKU	Product Name	Product Unit	Qty	Supplier Email

User Name
User Email
Additional Comments