AG00643P

6769-80-8 | p-Toluidine 5-bromo-6-chloro-1H-indol-3-yl phosphate

AG00643P

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CAS Number	6769-80-8
Catalog Number	AG00643P(AGN-PC-0TPTJZ)
Chemical Name	p-Toluidine 5-bromo-6-chloro-1H-indol-3-yl phosphate
IUPAC Name	(5-bromo-6-chloro-1H-indol-3-yl) dihydrogen phosphate;4-methylaniline
InChI	InChI=1S/C8H6BrClNO4P.C7H9N/c9-5-1-4-7(2-6(5)10)11-3-8(4)15-16(12,13)14;1-6-2-4-7(8)5-3-6/h1-3,11H,(H2,12,13,14);2-5H,8H2,1H3
InChI Key	WUHVYTJTZAKPOS-UHFFFAOYSA-N
MDL Number	MFCD00210023
Molecular Formula	C15H15BrClN2O4P
Molecular Weight	433.6214
SMILES	NC1=CC=C(C)C=C1.O=P(O)(O)OC2=CNC3=C2C=C(Br)C(Cl)=C3
Synonyms	5-bromo-6-chloro-3-indolyl-phosphate p-toluidine salt, magenta phosphate, 6769-80-8, Magenta phosphate, p-Toluidine 5-bromo-6-chloro-1H-indol-3-yl phosphate, 5-Bromo-6-chloro-3-indolyl phosphate p-toluidine salt, MFCD00210023, 5-Bromo-6-chloro-3-indolyl-phosphate p-toluidine salt, 154201-85-1, Magenta™ phosphate, AC1L4UQF, AC1Q25YQ, SCHEMBL2124028, BIB6006, DTXSID70165559, Magenta phosphate p-toludine salt, ZX-AFC000250, CS-D1382, KS-00000F2W, GC4671, 5-bromo-6-chloro-1h-indol-3-yl dihydrogen phosphate- 4-methylaniline(1:1), AK163109, AX8102992, FT-0620146, ST24048868, A-7351, 5-Bromo-6-chloro-3-indolyl phosphate, p-toluidine salt, (5-bromo-6-chloro-1H-indol-3-yl)oxyphosphonic acid; P-toluidine, (5-bromo-6-chloro-1H-indol-3-yl) dihydrogen phosphate; 4-methylaniline, 5-Bromo-6-chloro-3-indolyl phosphate p-toluidine salt, ~97% (HPLC), 1H-Indol-3-ol, 5-bromo-6-chloro-, 3-(dihydrogen phosphate), compd. with 4-methylbenzenamine, AR-1G7476, CID192667, ACN-051920, B-7550, 5-BROMO-6-CHLORO-3-INDOLYLPHOSPHATEP-TOLUIDINESALT, 5-BROMO-6-CHLORO-3-INDOXYL PHOSPHATE, p-toluidine salt, 5-Bromo-6-chloro-3-indolyl phosphate p-toluidine salt, 98% - 250mg 250mg, 784-62-3,

Complexity	377
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	2
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	431.964g/mol
Formal Charge	0
Heavy Atom Count	24
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	4
Isotope Atom Count	0
Molecular Weight	433.623g/mol
Monoisotopic Mass	431.964g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	109A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

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