Methylstat, 98.34%

Name: Methylstat
Brand: Chempure

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CAS Number

1310877-95-2

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IUPAC name	methyl (E)-4-[hydroxy-[4-[[4-(naphthalen-1-ylcarbamoyloxymethyl)phenyl]methylamino]butyl]amino]-4-oxobut-2-enoate
inchi	InChI=1S/C28H31N3O6/c1-36-27(33)16-15-26(32)31(35)18-5-4-17-29-19-21-11-13-22(14-12-21)20-37-28(34)30-25-10-6-8-23-7-2-3-9-24(23)25/h2-3,6-16,29,35H,4-5,17-20H2,1H3,(H,30,34)/b16-15+
inchi key	MUJOCHRZXRZONW-FOCLMDBBSA-N
molecular formula	C28H31N3O6
synonyms	METHYLSTAT 1310877-95-2 methyl (E)-4-[hydroxy-[4-[[4-(naphthalen-1-ylcarbamoyloxymethyl)phenyl]methylamino]butyl]amino]-4-oxobut-2-enoate (2E)-4-[Hydroxy[4-[[[4-[[[(1-naphthalenylamino)carbonyl]oxy]methyl]phenyl]methyl]-amino]butyl]amino]-4-oxo-2-butenoic acid methyl ester CHEMBL3347630
Compound Description	4-[hydroxy-[4-[[4-[[-oxomethoxy]methyl]phenyl]methylamino]butyl]amino]-4-oxo-2-butenoic acid methyl ester is a member of naphthalenes.

Computed Properties

Molecular Weight:	505.6 g/mol
XLogP3:	3.4
Hydrogen Bond Donor Count:	3
Hydrogen Bond Acceptor Count:	7
Rotatable Bond Count:	14
Exact Mass:	505.22128572 g/mol
Monoisotopic Mass:	505.22128572 g/mol
Topological Polar Surface Area:	117 Å²
Heavy Atom Count:	37
Formal Charge:	0
Complexity:	752
Isotope Atom Count:	0
Defined Atom Stereocenter Count:	0
Undefined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	1
Undefined Bond Stereocenter Count:	0
Covalently-Bonded Unit Count:	1
Compound Is Canonicalized:	Yes

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Product No: AS0843

Methylstat, 98.34%

Product No: AS0843

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Product No: AS0843

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NAME AND IDENTIFIERS

CHEMICAL AND PHYSICAL PROPERTIES

Require a Sample Certificate of Analysis (COA) ?