AG002RXC

2616-72-0 | 2-Naphthalenecarboxamide, N-(4-chloro-2-methylphenyl)-3-(phosphonooxy)-

AG002RXC

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CAS Number	2616-72-0
Catalog Number	AG002RXC(AGN-PC-0R22PI)
Chemical Name	2-Naphthalenecarboxamide, N-(4-chloro-2-methylphenyl)-3-(phosphonooxy)-
EC Number	220-046-7
IUPAC Name	[3-[(4-chloro-2-methylphenyl)carbamoyl]naphthalen-2-yl] dihydrogen phosphate
InChI	InChI=1S/C18H15ClNO5P/c1-11-8-14(19)6-7-16(11)20-18(21)15-9-12-4-2-3-5-13(12)10-17(15)25-26(22,23)24/h2-10H,1H3,(H,20,21)(H2,22,23,24)
InChI Key	SHTFMUPUBYXPCD-UHFFFAOYSA-N
MDL Number	MFCD00042716
Molecular Formula	C18H15ClNO5P
Molecular Weight	391.7422
SMILES	O=P(O)(OC1=C(C(NC2=CC=C(Cl)C=C2C)=O)C=C3C=CC=CC3=C1)O
Synonyms	naphthol AS-TR phosphate, NASTRp compound, 2616-72-0, Naphthol AS-TR phosphate, N-(4-Chloro-2-methylphenyl)-3-(phosphonooxy)naphthalene-2-carboxamide, 3-((4-Chloro-2-methylphenyl)carbamoyl)naphthalen-2-yl dihydrogen phosphate, [3-[(4-chloro-2-methylphenyl)carbamoyl]naphthalen-2-yl] dihydrogen phosphate, 2-Naphthalenecarboxamide,N-(4-chloro-2-methylphenyl)-3-(phosphonooxy)-, EINECS 220-046-7, naphthol-as-tr-phosphate, AC1L2PJ4, AC1Q3S4O, SCHEMBL2563831, CTK4F7216, DTXSID10180781, KS-000012YI, ZINC1841138, MFCD00042716, 3-[(4-chloro-2-methylphenyl)carbamoyl]-2-naphthyl dihydrogen phosphate, AKOS015913347, API0003515, MCULE-5595330179, VZ32942, AJ-31767, AK126483, CC-31469, AX8016830, DB-046851, TR-031530, FT-0634397, ST50410884, NaphtholAS-TRPhosphate[forBiochemicalResearch], C-21559, Naphthol AS-TR phosphate [for biochemical research], I14-46115, 3-[2-Methyl-4-chlorophenylcarbamyl]-2-naphthylphosphate, 3-[(4-Chloro-o-tolyl)carbamoyl]-2-naphthylphosphoric Acid, 3-[2-Methyl-4-chlorophenylcarbamyl]-2- naphthylphosphate, Naphthol AS-TR phosphate, for histology, >=98.0% (HPLC), {3-[(4-chloro-2-methylphenyl)carbamoyl]naphthalen-2-yl}oxyphosphonic acid, 2-Naphthalenecarboxamide, N-(4-chloro-2-methylphenyl)-3-(phosphonooxy)-, 3-(4-chloro-2-methylphenylcarbamoyl)naphthalen-2-yl dihydrogen phosphate, 3-[(4-chloro-2-methylanilino)carbonyl]-2-naphthyl dihydrogen phosphate, 3-[N-(4-chloro-2-methylphenyl)carbamoyl](2-naphthyl) dihydrogen phosphate, N-(4-Chloro-2-methylphenyl)-3-(phosphonooxy)-2-naphthalenecarboxamide, N-(4-Chloro-2-methylphenyl)-3-(phosphonooxy)naphthalene-2carboxamide, C18H15ClNO5P, C18-H15-Cl-N-O5-P, CID75794, AR-1F0598, C2250, 3-((4-Chloro-2-methylphenyl)carbamoyl)naphthalen-2-yldihydrogenphosphate, 26988-01-2,

Complexity	556
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	391.038g/mol
Formal Charge	0
Heavy Atom Count	26
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	3
Isotope Atom Count	0
Molecular Weight	391.744g/mol
Monoisotopic Mass	391.038g/mol
Rotatable Bond Count	4
Topological Polar Surface Area	95.9A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3.3

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

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