ORM-10103

CAT: 0607-BA6788-50Size: 50 mgDry Ice: NoHazardous: No

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CAT#:0607-BA6788-50Size:50 mg

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24/48H Stock Items & 2 to 6 Weeks non Stock Items.

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CAS Number

488847-28-5

Form

A solid

Molecular Formula

C20H16N2O4

Molecular Weight

348.35

Shipping Conditions

Blue ice

Storage Conditions

-20°C.

Chemical Information

Orm-10103

CAS Number	488847-28-5
PubChem CID	17978512
IUPAC Name	5-nitro-2-[(2-phenyl-3,4-dihydro-2H-chromen-6-yl)oxy]pyridine
Molecular Formula	C20H16N2O4
Molecular Weight	348.4
XLogP	4.4
Topological Polar Surface Area	77.2
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	3
Heavy Atom Count	26
Formal Charge	0
Complexity	477

SMILES

C1CC2=C(C=CC(=C2)OC3=NC=C(C=C3)[N+](=O)[O-])OC1C4=CC=CC=C4

InChI

InChI=1S/C20H16N2O4/c23-22(24)16-7-11-20(21-13-16)25-17-8-10-19-15(12-17)6-9-18(26-19)14-4-2-1-3-5-14/h1-5,7-8,10-13,18H,6,9H2

InChIKey

GZONLGPIHCCJOI-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 488847-28-5

CID: 17978512

Formula: C20H16N2O4

MW: 348.4

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	348.4
XLogP3	4.4
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	3
Exact Mass	348.11100700
Monoisotopic Mass	348.11100700
Topological Polar Surface Area	77.2 Å²
Heavy Atom Count	26
Formal Charge	0
Complexity	477
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
BA6787-5.1	ORM-10962
BA6787-1	ORM-10962
BA6787-10	ORM-10962
BA6787-5	ORM-10962
BA1354-5	PNU-101603
BA1354-25	PNU-101603
BA1354-10	PNU-101603
BA2916-1	JNJ-1013
BA2916-5	JNJ-1013
MA4116-.05	Anti-ORM1 Rabbit Monoclonal Antibody