Naftalofos

CAT: 0024-sc-228811ASize: 100 mgDry Ice: NoHazardous: No

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CAT#:0024-sc-228811ASize:100 mg

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24/48H Stock Items & 2 to 6 Weeks non Stock Items.

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CAS Number

1491-41-4

Chemical Information

Naftalofos

Naftalofos is an organic heterotricyclic compound. It has a role as an anthelminthic drug.

CAS Number	1491-41-4
PubChem CID	15148
IUPAC Name	(1,3-dioxobenzo[de]isoquinolin-2-yl) diethyl phosphate
Molecular Formula	C16H16NO6P
Molecular Weight	349.27
XLogP	2.4
Topological Polar Surface Area	82.1
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	6
Rotatable Bond Count	6
Heavy Atom Count	24
Formal Charge	0
Complexity	513

SMILES

CCOP(=O)(OCC)ON1C(=O)C2=CC=CC3=C2C(=CC=C3)C1=O

InChI

InChI=1S/C16H16NO6P/c1-3-21-24(20,22-4-2)23-17-15(18)12-9-5-7-11-8-6-10-13(14(11)12)16(17)19/h5-10H,3-4H2,1-2H3

InChIKey

QNSIFYWAPWSAIJ-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 1491-41-4

CID: 15148

Formula: C16H16NO6P

MW: 349.27

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	349.27
XLogP3	2.4
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	6
Rotatable Bond Count	6
Exact Mass	349.07152423
Monoisotopic Mass	349.07152423
Topological Polar Surface Area	82.1 Å²
Heavy Atom Count	24
Formal Charge	0
Complexity	513
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
GTR19201700-01	Naftalofos