Naphthol AS phosphate

CAT: 0024-sc-206000CSize: 5 gDry Ice: NoHazardous: No

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CAT#:0024-sc-206000CSize:5 g

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CAS Number

13989-98-5

Chemical Information

3-(Phenylcarbamoyl)naphthalen-2-yl dihydrogen phosphate

CAS Number	13989-98-5
PubChem CID	84137
IUPAC Name	[3-(phenylcarbamoyl)naphthalen-2-yl] dihydrogen phosphate
Molecular Formula	C17H14NO5P
Molecular Weight	343.27
XLogP	2.3
Topological Polar Surface Area	95.9
Hydrogen Bond Donor Count	3
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	4
Heavy Atom Count	24
Formal Charge	0
Complexity	487

SMILES

C1=CC=C(C=C1)NC(=O)C2=CC3=CC=CC=C3C=C2OP(=O)(O)O

InChI

InChI=1S/C17H14NO5P/c19-17(18-14-8-2-1-3-9-14)15-10-12-6-4-5-7-13(12)11-16(15)23-24(20,21)22/h1-11H,(H,18,19)(H2,20,21,22)

InChIKey

KVIYXIWBXOQZDN-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 13989-98-5

CID: 84137

Formula: C17H14NO5P

MW: 343.27

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	343.27
XLogP3	2.3
Hydrogen Bond Donor Count	3
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	4
Exact Mass	343.06095954
Monoisotopic Mass	343.06095954
Topological Polar Surface Area	95.9 Å²
Heavy Atom Count	24
Formal Charge	0
Complexity	487
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
sc-286554	Naphthol AS-D phosphate
sc-487557	Naphthol AS-TR Phosphate
sc-222042A	Naphthol AS-BI-phosphate
sc-215542	Naphthol AS-OL phosphate
sc-222042	Naphthol AS-BI-phosphate
sc-286554A	Naphthol AS-D phosphate
sc-215542A	Naphthol AS-OL phosphate
sc-215539A	Naphthol AS-MX phosphate disodium salt
sc-253179A	Naphthol AS-TR phosphate disodium salt
sc-253179	Naphthol AS-TR phosphate disodium salt

Catalog	Name
285805-01	Naphthol AS phosphate
A9086-100	Naphthol AS-MX phosphate
EN70036-01	Naphthol AS-TR phosphate
EN67711-01	Naphthol AS-CL phosphate
FN15225-01	Naphthol AS-BI-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
HY-W787630	Naphthol AS phosphate disodium salt