Naphthol AS-D phosphate

CAT: 0024-sc-286554Size: 100 mgDry Ice: NoHazardous: No

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CAT#:0024-sc-286554Size:100 mg

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CAS Number

27580-13-8

Chemical Information

3-(Phosphonooxy)-N-(o-tolyl)naphthalene-2-carboxamide

CAS Number	27580-13-8
PubChem CID	119660
IUPAC Name	[3-[(2-methylphenyl)carbamoyl]naphthalen-2-yl] dihydrogen phosphate
Molecular Formula	C18H16NO5P
Molecular Weight	357.3
XLogP	2.7
Topological Polar Surface Area	95.9
Hydrogen Bond Donor Count	3
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	4
Heavy Atom Count	25
Formal Charge	0
Complexity	522

SMILES

CC1=CC=CC=C1NC(=O)C2=CC3=CC=CC=C3C=C2OP(=O)(O)O

InChI

InChI=1S/C18H16NO5P/c1-12-6-2-5-9-16(12)19-18(20)15-10-13-7-3-4-8-14(13)11-17(15)24-25(21,22)23/h2-11H,1H3,(H,19,20)(H2,21,22,23)

InChIKey

NQMNDWPDYBPJNO-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 27580-13-8

CID: 119660

Formula: C18H16NO5P

MW: 357.3

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	357.3
XLogP3	2.7
Hydrogen Bond Donor Count	3
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	4
Exact Mass	357.07660961
Monoisotopic Mass	357.07660961
Topological Polar Surface Area	95.9 Å²
Heavy Atom Count	25
Formal Charge	0
Complexity	522
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
285805-01	Naphthol AS phosphate
HY-W142459-01	Naphthol AS-D
EN70036-01	Naphthol AS-TR phosphate
EN67711-01	Naphthol AS-CL phosphate
FN15225-01	Naphthol AS-BI-phosphate
41400004-1	Naphthol AS-MX Phosphate
240838-01	Naphthol As-BI phosphate
GW0166-500mg	Naphthol AS-E phosphate
EN69791-01	Naphthol AS-E phosphate, 60%
40180015-1	Naphthol AS Phosphate, Disodium Salt