Methoxyresorufin 10mg

CAT: 0628-A13367-10Size: 10 mgDry Ice: NoHazardous: No

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CAT#:0628-A13367-10Size:10 mg

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CAS Number

5725-89-3

Chemical Information

7-Methoxyresorufin

CAS Number	5725-89-3
PubChem CID	119220
IUPAC Name	7-methoxyphenoxazin-3-one
Molecular Formula	C13H9NO3
Molecular Weight	227.21
XLogP	1.5
Topological Polar Surface Area	47.9
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	1
Heavy Atom Count	17
Formal Charge	0
Complexity	436

SMILES

COC1=CC2=C(C=C1)N=C3C=CC(=O)C=C3O2

InChI

InChI=1S/C13H9NO3/c1-16-9-3-5-11-13(7-9)17-12-6-8(15)2-4-10(12)14-11/h2-7H,1H3

InChIKey

KNYYMGDYROYBRE-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 5725-89-3

CID: 119220

Formula: C13H9NO3

MW: 227.21

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	227.21
XLogP3	1.5
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	1
Exact Mass	227.058243149
Monoisotopic Mass	227.058243149
Topological Polar Surface Area	47.9 Å²
Heavy Atom Count	17
Formal Charge	0
Complexity	436
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
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